data_1c15_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 1c15 _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 ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.166 0.507 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -59.16 -35.71 74.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 110.516 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.06 -40.78 74.08 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.096 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -62.29 -32.49 73.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.37 -0.831 . . . . 0.0 109.653 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 0.406 ' HA ' HD12 ' A' ' 10' ' ' LEU . 96.2 m-20 -77.88 -25.14 48.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.924 179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 t -59.75 -54.19 49.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.935 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.453 ' CD2' ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -62.47 -36.92 84.0 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.406 -0.809 . . . . 0.0 109.614 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 7' ' ' ASN . 12.3 mt -67.93 -35.3 78.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 109.54 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -90.79 2.64 55.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.42 -0.8 . . . . 0.0 110.122 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 12' ' ' HIS . 72.3 t60 -92.59 19.04 7.78 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.302 -0.874 . . . . 0.0 110.224 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -69.21 -44.29 72.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 110.138 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.48 -32.61 74.32 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.395 -0.815 . . . . 0.0 110.169 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.28 -42.31 55.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.326 -0.859 . . . . 0.0 110.169 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.455 ' HG ' ' HB ' ' A' ' 20' ' ' ILE . 5.2 tt -75.93 -37.42 58.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.426 -0.796 . . . . 0.0 110.244 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -53.53 -41.44 66.38 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.406 -0.809 . . . . 0.0 110.469 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -85.46 -34.32 21.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.512 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.22 -65.53 1.0 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.256 -0.903 . . . . 0.0 110.782 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.455 ' HB ' ' HG ' ' A' ' 16' ' ' LEU . 11.0 mm -108.44 111.13 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.295 -0.878 . . . . 0.0 110.647 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.565 ' O ' ' C ' ' A' ' 22' ' ' THR . 4.3 mtpt -97.06 141.75 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.598 -0.689 . . . . 0.0 109.349 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 21' ' ' LYS . 69.5 p -24.44 97.4 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 CA-C-O 121.455 0.645 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 27.5 t -157.36 -176.8 6.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.556 -0.715 . . . . 0.0 110.154 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 15.9 t80 -33.54 -41.58 0.09 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.773 -0.58 . . . . 0.0 111.788 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.41 HG13 HD11 ' A' ' 20' ' ' ILE . 44.0 mm -59.38 -50.01 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.053 -1.03 . . . . 0.0 110.007 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -75.65 -37.49 59.62 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.339 -0.851 . . . . 0.0 110.439 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -72.35 -57.56 4.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.255 -0.903 . . . . 0.0 110.605 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -51.7 -25.22 6.87 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.313 -0.867 . . . . 0.0 110.579 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.6 -57.07 3.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.308 -0.87 . . . . 0.0 110.174 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -57.12 -47.33 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.271 -0.893 . . . . 0.0 109.937 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 75.0 m -66.27 -15.15 62.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.377 -0.827 . . . . 0.0 110.36 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -59.67 -28.91 67.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.284 -0.885 . . . . 0.0 110.395 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.32 -18.11 1.33 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.186 -1.166 . . . . 0.0 110.186 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -54.5 -60.7 2.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.122 -1.222 . . . . 0.0 110.315 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mt -121.66 162.97 19.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.417 -0.802 . . . . 0.0 110.265 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.8 p -60.72 147.73 41.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.343 -0.848 . . . . 0.0 110.401 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 88.8 mt -71.37 -17.84 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.398 -0.814 . . . . 0.0 110.242 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 m -58.82 -27.88 65.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.326 -0.859 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -68.43 -26.51 65.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.4 -0.813 . . . . 0.0 110.159 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -63.32 -49.14 75.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.361 -0.837 . . . . 0.0 110.192 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -60.75 -27.97 68.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 110.182 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.401 ' O ' ' N ' ' A' ' 46' ' ' GLU . 15.6 tttt -77.92 -58.58 3.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 110.064 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.402 ' O ' ' HD2' ' A' ' 47' ' ' PRO . 65.9 t -50.91 -33.4 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.408 -0.808 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.6 ttp85 -50.8 -42.86 58.55 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.256 -0.903 . . . . 0.0 111.34 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -134.27 8.95 3.73 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.029 -1.044 . . . . 0.0 111.455 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.561 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.0 tp10 -73.96 -53.6 3.96 Favored Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.033 -1.042 . . . . 0.0 110.186 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.561 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -74.41 170.29 20.57 Favored 'Trans proline' 0 C--N 1.313 -1.325 0 O-C-N 123.388 1.204 . . . . 0.0 110.269 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.3 m -135.84 -38.23 0.72 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.391 -0.818 . . . . 0.0 110.436 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -104.25 -157.46 0.61 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.849 . . . . 0.0 110.262 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -58.09 -19.83 35.1 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.344 -0.847 . . . . 0.0 110.55 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -52.84 -23.82 7.77 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.238 -0.913 . . . . 0.0 110.56 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.1 ttp180 -52.98 -53.14 54.31 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.265 -0.897 . . . . 0.0 110.319 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.441 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -80.67 -8.65 59.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.86 . . . . 0.0 110.412 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -83.85 -36.01 23.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.1 -1.0 . . . . 0.0 110.054 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.4 tpp -81.21 -27.4 35.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.353 -0.842 . . . . 0.0 110.162 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -68.87 -38.22 79.57 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.364 -0.835 . . . . 0.0 110.091 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.572 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.1 mp -74.15 -45.76 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.317 -0.864 . . . . 0.0 109.825 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -60.64 -38.44 84.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.256 -0.902 . . . . 0.0 109.675 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.4 mmt -56.55 -36.06 68.84 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.386 -0.821 . . . . 0.0 110.113 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 79.1 mt -58.02 -52.47 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.322 -0.861 . . . . 0.0 109.916 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.424 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.5 mm? -77.37 -29.43 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.412 -0.805 . . . . 0.0 110.706 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -58.58 -25.89 63.04 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.183 -0.948 . . . . 0.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.8 tptm -83.68 -65.57 0.99 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.908 . . . . 0.0 110.271 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -160.54 170.19 21.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.374 -0.829 . . . . 0.0 110.297 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -84.16 -20.11 32.98 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.421 -0.799 . . . . 0.0 110.271 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -60.41 -43.04 97.11 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.25 -0.906 . . . . 0.0 110.294 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.1 t -61.32 -32.48 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.41 -0.806 . . . . 0.0 110.309 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.453 ' CE1' ' CD2' ' A' ' 9' ' ' LEU . 6.4 t80 -64.1 -37.18 86.51 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.384 -0.823 . . . . 0.0 110.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.07 -31.82 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.37 -0.831 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.0 t -69.88 -43.57 71.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.294 -0.879 . . . . 0.0 110.019 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.423 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 1.1 t80 -53.93 -35.69 61.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.334 -0.854 . . . . 0.0 109.612 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.453 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 25.2 t80 -63.74 -38.5 91.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.499 -0.75 . . . . 0.0 109.858 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -82.96 -25.52 32.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.405 -0.809 . . . . 0.0 110.158 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.43 80.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 80' ' ' TYR . 45.1 mt -78.36 -40.08 37.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.42 -0.8 . . . . 0.0 110.151 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.5 mt -65.68 -15.5 62.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.359 -0.838 . . . . 0.0 110.397 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -65.36 -26.32 67.97 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.224 -0.922 . . . . 0.0 110.58 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -108.01 -75.16 0.64 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.922 . . . . 0.0 110.595 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.0 62.93 0.11 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.425 ' CD2' HD22 ' A' ' 75' ' ' LEU . 26.1 m-85 -124.93 16.25 8.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.435 -1.039 . . . . 0.0 110.478 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -46.32 -29.21 1.56 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.376 -0.827 . . . . 0.0 111.031 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.13 -65.05 0.75 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.301 -0.875 . . . . 0.0 110.077 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.5 tt -66.77 -39.8 87.99 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 110.028 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.45 -39.26 60.86 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.278 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.16 90.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.791 . . . . 0.0 109.902 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.6 tt -52.52 -46.4 66.67 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.4 -0.812 . . . . 0.0 110.568 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.3 mp -73.06 -48.5 35.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.358 -0.839 . . . . 0.0 110.288 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.453 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 78.1 t60 -65.37 -16.09 63.25 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.388 -0.82 . . . . 0.0 110.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -85.02 -14.77 46.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.191 -0.943 . . . . 0.0 110.747 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -111.33 -22.86 5.97 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.573 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 54.7 mt -60.59 -52.06 75.39 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.154 -1.204 . . . . 0.0 110.822 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.573 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.6 Cg_endo . . . . . 0 C--N 1.315 -1.23 0 O-C-N 123.221 1.116 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.171 0.51 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -63.35 -32.43 73.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.263 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.32 95.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.382 -0.824 . . . . 0.0 110.071 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -65.62 -29.66 70.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.367 -0.833 . . . . 0.0 110.126 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -74.08 -31.73 62.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.4 -0.813 . . . . 0.0 110.142 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 47.1 t -60.63 -51.9 67.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.4 -0.812 . . . . 0.0 110.294 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.406 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -61.98 -35.26 77.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.368 -0.832 . . . . 0.0 110.057 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.4 mt -63.14 -34.36 77.44 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.278 -0.889 . . . . 0.0 109.89 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -97.02 24.98 5.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.391 -0.818 . . . . 0.0 110.066 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.411 ' CD2' ' HB2' ' A' ' 16' ' ' LEU . 63.6 t60 -94.81 20.02 9.33 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.336 -0.853 . . . . 0.0 110.451 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 70.4 ttp85 -69.29 -56.94 6.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.308 -0.87 . . . . 0.0 110.114 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -65.14 -35.27 80.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.289 -0.882 . . . . 0.0 110.101 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.0 -46.24 65.55 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.371 -0.831 . . . . 0.0 110.298 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.411 ' HB2' ' CD2' ' A' ' 12' ' ' HIS . 1.2 tp -59.35 -39.95 84.85 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.38 -41.64 66.09 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.403 -0.811 . . . . 0.0 110.265 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -85.06 -23.22 28.65 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.391 -0.818 . . . . 0.0 110.152 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.99 -65.25 1.03 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.256 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.431 HG22 HD12 ' A' ' 20' ' ' ILE . 14.8 mt -147.24 158.38 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.335 -0.853 . . . . 0.0 110.52 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.577 ' O ' ' C ' ' A' ' 22' ' ' THR . 5.6 mttt -114.34 141.91 47.0 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 21' ' ' LYS . 58.9 p -24.23 98.75 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 CA-C-O 121.516 0.674 . . . . 0.0 110.999 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.8 t -152.06 -176.22 5.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.568 -0.707 . . . . 0.0 110.308 -178.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.9 t80 -32.87 -38.94 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.866 -0.521 . . . . 0.0 112.224 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 43.9 mm -55.89 -66.31 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 120.954 -1.091 . . . . 0.0 110.175 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.4 ' CE ' ' CD1' ' A' ' 57' ' ' ILE . 13.9 mmm -76.53 -35.93 58.0 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.36 -0.837 . . . . 0.0 110.259 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.14 -52.68 64.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.432 -0.792 . . . . 0.0 110.458 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -58.49 -29.7 66.44 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.304 -0.872 . . . . 0.0 110.248 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.5 mtt -69.8 -42.5 73.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.271 -0.893 . . . . 0.0 110.294 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.2 mt -55.16 -50.24 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.258 -0.901 . . . . 0.0 110.196 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.1 m -74.34 -14.97 60.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.409 -0.807 . . . . 0.0 110.301 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.28 -31.2 65.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.268 -0.895 . . . . 0.0 110.45 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 147.47 -20.03 1.51 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.972 -1.251 . . . . 0.0 109.972 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.409 ' CE1' ' HA ' ' A' ' 67' ' ' SER . 20.7 m-85 -57.15 -51.65 68.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.163 -1.198 . . . . 0.0 110.203 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mp -132.12 155.48 48.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.367 -0.833 . . . . 0.0 110.115 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.4 p -57.48 160.22 4.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.414 -0.804 . . . . 0.0 110.324 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 0.419 HG23 HD11 ' A' ' 37' ' ' ILE . 84.2 mt -71.19 -15.31 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.372 -0.83 . . . . 0.0 110.322 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.3 m -56.18 -26.17 49.64 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.276 -0.89 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -66.55 -34.03 77.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.321 -0.862 . . . . 0.0 110.219 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -68.46 -37.11 79.9 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.315 -0.865 . . . . 0.0 110.174 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.21 -33.82 76.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.428 -0.795 . . . . 0.0 110.1 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -75.99 -60.56 2.27 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.354 -0.841 . . . . 0.0 110.1 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 80.4 t -48.53 -33.6 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.491 -0.755 . . . . 0.0 110.546 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -43.8 -48.71 8.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.643 -0.661 . . . . 0.0 111.403 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -145.26 14.36 1.45 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.118 -0.989 . . . . 0.0 111.235 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.615 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.1 tp10 -80.17 -47.84 1.33 Allowed Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.032 -1.042 . . . . 0.0 110.962 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.615 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -75.99 170.25 20.49 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.154 1.081 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.7 m -145.86 -45.41 0.21 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.362 -0.836 . . . . 0.0 110.289 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -91.51 -166.87 1.66 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.378 -0.826 . . . . 0.0 110.305 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -17.78 45.29 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.359 -0.838 . . . . 0.0 110.498 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -57.04 -18.89 15.88 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.253 -0.905 . . . . 0.0 110.556 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -49.53 -60.86 2.47 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.353 -0.842 . . . . 0.0 110.579 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.437 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -74.14 -52.57 12.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.152 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.97 -34.21 5.35 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.385 -0.822 . . . . 0.0 110.622 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.6 ttp -82.95 -25.56 32.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 tt -81.45 -35.69 30.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.345 -0.847 . . . . 0.0 110.342 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.441 HD13 HG23 ' A' ' 57' ' ' ILE . 41.7 mm -64.21 -43.15 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.244 -0.91 . . . . 0.0 109.934 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -61.06 -41.1 95.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.345 -0.847 . . . . 0.0 109.915 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.1 mtp -56.23 -33.33 65.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.303 -0.873 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.6 mt -61.19 -53.72 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.241 -0.912 . . . . 0.0 109.985 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.406 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.0 mm? -76.76 -30.22 56.45 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.473 -0.767 . . . . 0.0 110.506 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -26.62 66.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.302 -0.874 . . . . 0.0 110.221 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -64.99 1.03 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.356 -0.84 . . . . 0.0 110.166 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -159.93 155.74 26.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.401 -0.812 . . . . 0.0 110.219 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -77.23 -23.9 51.3 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.357 -0.84 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.08 -29.65 68.72 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.377 -0.827 . . . . 0.0 110.283 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.409 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 12.2 t -68.93 -34.91 76.14 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.304 -0.873 . . . . 0.0 110.053 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -62.45 -34.6 77.13 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.452 -0.78 . . . . 0.0 110.01 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.89 -40.85 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.41 -0.807 . . . . 0.0 110.033 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -69.42 -34.69 74.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.306 -0.871 . . . . 0.0 110.086 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.461 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 32.6 t80 -53.14 -35.48 59.78 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.054 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.404 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 47.6 t80 -70.68 -44.6 66.69 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.333 -0.854 . . . . 0.0 110.198 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -73.26 -27.88 61.82 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.37 -0.831 . . . . 0.0 110.479 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -48.9 65.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.294 -0.879 . . . . 0.0 110.384 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.461 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 14.9 mt -66.46 -44.61 82.31 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.333 -0.855 . . . . 0.0 110.351 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 35.1 mt -65.32 -15.03 62.11 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 110.544 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -63.33 -24.46 67.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.204 -0.935 . . . . 0.0 110.632 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -112.03 -75.24 0.61 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.206 -0.933 . . . . 0.0 110.543 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -170.8 66.19 0.15 Allowed Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -125.09 16.37 8.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -1.039 . . . . 0.0 110.481 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -43.14 -31.3 0.56 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.914 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.6 -42.08 59.31 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.387 -0.82 . . . . 0.0 109.779 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.402 ' CD1' ' C ' ' A' ' 83' ' ' LEU . 3.4 tm? -73.24 -44.57 59.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.48 -0.763 . . . . 0.0 109.848 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.404 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.34 -33.55 73.81 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.391 -0.818 . . . . 0.0 110.043 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.42 -36.44 82.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 110.113 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.12 -56.96 15.26 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.421 -0.8 . . . . 0.0 110.23 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.24 -35.69 76.39 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.906 . . . . 0.0 110.072 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.404 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 49.1 t60 -62.15 -37.57 85.71 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -65.96 -17.56 64.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.426 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -102.57 -2.11 50.1 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.508 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 18.5 mt -72.04 -55.48 5.14 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.278 . . . . 0.0 110.34 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.508 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.1 Cg_endo . . . . . 0 C--N 1.313 -1.337 0 O-C-N 123.265 1.139 . . . . 0.0 110.54 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.127 0.489 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -56.19 -39.5 72.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.32 -0.863 . . . . 0.0 110.458 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.09 -36.98 83.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.287 -0.883 . . . . 0.0 110.188 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -72.01 -44.09 63.99 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.89 -25.21 67.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.296 -0.877 . . . . 0.0 110.238 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.75 -57.59 10.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.338 -0.851 . . . . 0.0 110.141 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.408 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -56.4 -34.75 67.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.315 -0.866 . . . . 0.0 110.131 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 90.9 mt -80.6 -20.34 43.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.35 -0.844 . . . . 0.0 110.429 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -110.53 31.49 5.92 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -0.856 . . . . 0.0 110.381 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.5 t-160 -142.41 45.0 1.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.351 -0.843 . . . . 0.0 109.987 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -75.09 -37.31 61.59 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.442 -0.786 . . . . 0.0 110.507 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.43 -35.47 65.44 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.175 -0.953 . . . . 0.0 110.595 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.433 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -85.59 -56.3 3.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.288 -0.882 . . . . 0.0 110.312 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.7 tp -55.85 -42.64 76.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.343 -0.848 . . . . 0.0 110.59 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -60.51 -49.29 78.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 0.0 110.079 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -72.19 -26.35 62.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.364 -0.835 . . . . 0.0 110.04 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -72.41 -58.65 3.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.85 . . . . 0.0 110.09 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.416 HD13 HG13 ' A' ' 25' ' ' ILE . 22.8 mt -135.59 109.86 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.366 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.567 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.8 mttt -79.45 142.67 35.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.556 -0.715 . . . . 0.0 109.558 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.567 ' C ' ' O ' ' A' ' 21' ' ' LYS . 61.6 p -23.75 97.34 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 CA-C-O 121.454 0.645 . . . . 0.0 111.09 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 24' ' ' TYR . 32.7 t -152.87 -176.52 5.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.712 -0.617 . . . . 0.0 110.222 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.446 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.7 t80 -33.0 -44.5 0.11 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.826 -0.546 . . . . 0.0 111.957 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.416 HG13 HD13 ' A' ' 20' ' ' ILE . 43.0 mm -54.74 -63.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.075 -1.016 . . . . 0.0 110.195 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 15.1 mtt -75.37 -39.03 59.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -59.79 -51.47 69.59 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.367 -0.833 . . . . 0.0 110.565 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -54.47 -36.1 63.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.268 -0.895 . . . . 0.0 110.337 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -32.19 73.5 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -0.825 . . . . 0.0 110.079 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.2 mm -60.78 -65.13 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.295 -0.878 . . . . 0.0 110.062 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -68.67 -18.62 64.31 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.395 -0.816 . . . . 0.0 110.551 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -24.44 25.89 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.184 -0.947 . . . . 0.0 110.374 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 -13.94 4.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' A' ' 67' ' ' SER . 25.0 m-85 -69.62 -55.24 10.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -1.187 . . . . 0.0 110.454 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.6 mp -121.83 165.17 16.29 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.326 -0.859 . . . . 0.0 110.416 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.0 p -65.16 147.68 53.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 110.24 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.1 mt -73.14 -20.85 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.412 -0.805 . . . . 0.0 110.219 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 m -57.91 -36.79 72.95 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.228 -0.92 . . . . 0.0 110.356 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.61 -26.84 68.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.368 -0.833 . . . . 0.0 110.212 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -68.69 -45.31 72.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.327 -0.858 . . . . 0.0 110.136 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -63.13 -36.42 83.55 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.316 -0.865 . . . . 0.0 110.152 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -58.24 3.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.423 -0.798 . . . . 0.0 110.179 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 68.9 t -50.83 -33.55 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.384 -0.823 . . . . 0.0 110.346 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -46.06 -32.4 2.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.509 -0.744 . . . . 0.0 111.468 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -145.42 21.7 1.51 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.01 -1.057 . . . . 0.0 111.309 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.433 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 0.3 OUTLIER -85.87 -54.53 0.41 Allowed Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.091 -1.006 . . . . 0.0 110.767 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.433 ' HD3' ' CB ' ' A' ' 46' ' ' GLU . 49.9 Cg_endo -77.22 163.87 29.84 Favored 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.456 1.24 . . . . 0.0 110.614 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.9 m -137.4 -42.96 0.55 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.348 -0.845 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.26 -161.25 0.57 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.056 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -15.07 56.17 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.299 -0.875 . . . . 0.0 110.636 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -55.98 -20.16 15.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.193 -0.942 . . . . 0.0 110.664 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -51.45 -54.82 23.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.168 -0.958 . . . . 0.0 110.606 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.36 -29.2 34.15 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.331 -0.856 . . . . 0.0 110.188 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.45 -32.16 72.99 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.257 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 4.9 ttt -80.63 -48.16 13.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.427 -0.795 . . . . 0.0 110.31 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.4 tp -58.68 -36.36 74.07 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.379 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.479 HD11 ' N ' ' A' ' 57' ' ' ILE . 0.2 OUTLIER -61.6 -44.47 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.434 -0.791 . . . . 0.0 109.672 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -70.28 -36.77 74.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.47 -0.769 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 21.4 mmt -59.52 -36.53 76.3 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.339 -0.851 . . . . 0.0 110.367 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.0 mt -60.67 -58.56 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.452 -0.78 . . . . 0.0 110.239 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.408 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 1.7 mm? -69.43 -40.28 77.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.572 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -59.08 -31.17 68.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.302 -0.874 . . . . 0.0 110.411 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -65.09 0.73 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.319 -0.863 . . . . 0.0 110.183 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -160.16 158.62 30.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.288 -0.882 . . . . 0.0 110.213 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -81.84 -26.86 33.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.456 -0.777 . . . . 0.0 110.194 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.52 -34.25 77.38 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.294 -0.879 . . . . 0.0 110.261 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.413 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 33.3 t -65.15 -36.89 85.65 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.353 -0.842 . . . . 0.0 110.155 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -59.25 -36.62 75.82 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.39 -0.819 . . . . 0.0 110.105 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.75 -46.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.361 -0.837 . . . . 0.0 109.986 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.5 t -62.02 -33.97 75.34 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.304 -0.873 . . . . 0.0 109.999 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.473 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 3.3 t80 -57.74 -36.67 72.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.35 -0.844 . . . . 0.0 109.787 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.426 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 34.6 t80 -62.74 -41.86 99.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.496 -0.752 . . . . 0.0 109.941 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.81 -27.35 40.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.4 -0.813 . . . . 0.0 110.225 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.37 -47.79 84.56 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.325 -0.86 . . . . 0.0 110.192 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.473 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 7.8 mt -66.78 -41.17 88.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.328 -0.857 . . . . 0.0 110.224 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 43.6 mt -66.68 -15.11 63.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.421 -0.799 . . . . 0.0 110.57 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -61.96 -22.41 65.62 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.191 -0.943 . . . . 0.0 110.549 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -112.53 -75.15 0.61 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.22 -0.925 . . . . 0.0 110.426 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.97 36.9 0.11 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.413 ' CE2' HD12 ' A' ' 20' ' ' ILE . 18.9 m-85 -93.78 16.44 14.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.458 -1.025 . . . . 0.0 110.49 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -42.19 -31.33 0.37 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.522 -0.736 . . . . 0.0 110.906 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -67.52 -48.1 68.01 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.356 -0.84 . . . . 0.0 109.703 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -78.09 -44.02 27.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.508 -0.745 . . . . 0.0 109.827 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.15 -43.47 92.06 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.349 -0.844 . . . . 0.0 110.238 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.03 -29.72 70.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.35 -0.844 . . . . 0.0 110.11 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.7 tp -57.43 -46.09 83.93 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.355 -0.841 . . . . 0.0 110.309 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mp -73.97 -33.42 63.86 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.426 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 13.3 t-160 -58.91 -25.77 63.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.348 -0.845 . . . . 0.0 110.386 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -85.04 -18.85 33.09 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.335 -0.853 . . . . 0.0 110.451 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -97.08 -26.98 9.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.555 ' N ' ' HD2' ' A' ' 92' ' ' PRO . 42.9 mt -56.87 -47.88 98.3 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.352 -1.087 . . . . 0.0 110.977 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo . . . . . 0 C--N 1.315 -1.225 0 O-C-N 123.223 1.117 . . . . 0.0 110.72 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.112 0.482 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -29.35 61.14 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.329 -0.857 . . . . 0.0 110.575 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.69 -38.04 88.84 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.235 -0.915 . . . . 0.0 110.223 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -68.1 -28.51 67.4 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.206 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -79.44 -27.21 41.68 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.351 -0.843 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.62 -51.0 70.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.474 -0.766 . . . . 0.0 110.165 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.415 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 3.0 tm? -62.53 -36.77 83.64 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.369 -0.832 . . . . 0.0 109.752 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.47 -27.53 62.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.319 -0.863 . . . . 0.0 110.137 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -98.07 27.47 4.55 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.285 -0.884 . . . . 0.0 110.121 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.43 ' CE1' HD23 ' A' ' 86' ' ' LEU . 3.5 t-160 -124.22 26.92 7.27 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.468 -0.77 . . . . 0.0 109.9 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -75.68 -36.58 60.03 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.286 -0.884 . . . . 0.0 110.475 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -68.36 -36.0 78.55 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.295 -0.878 . . . . 0.0 110.617 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.419 ' CB ' ' CD2' ' A' ' 12' ' ' HIS . . . -85.05 -30.28 24.24 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.361 -0.837 . . . . 0.0 110.027 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.405 ' CD2' ' CG1' ' A' ' 57' ' ' ILE . 1.3 tp -80.72 -44.03 19.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.395 -0.815 . . . . 0.0 110.032 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -59.16 -35.66 73.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.385 -0.822 . . . . 0.0 110.071 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -78.2 -41.78 33.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.38 -0.825 . . . . 0.0 110.285 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.24 -65.28 1.03 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.241 -0.912 . . . . 0.0 110.514 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 12.8 mm -94.95 109.69 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.544 ' O ' ' C ' ' A' ' 22' ' ' THR . 2.7 mtpm? -103.28 141.3 36.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.59 -0.694 . . . . 0.0 109.284 179.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.544 ' C ' ' O ' ' A' ' 21' ' ' LYS . 73.4 p -24.68 98.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.677 -0.64 . . . . 0.0 110.987 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.438 ' O ' ' C ' ' A' ' 24' ' ' TYR . 81.4 p -159.97 -176.58 5.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.559 -0.713 . . . . 0.0 110.377 -178.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.438 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.7 t80 -33.55 -39.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.86 -0.525 . . . . 0.0 111.939 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 44.8 mm -57.23 -65.69 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.029 -1.044 . . . . 0.0 109.997 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.11 -40.87 51.94 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 110.189 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -55.02 -60.02 3.95 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.363 -0.835 . . . . 0.0 110.717 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -56.73 -38.82 72.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.35 -0.844 . . . . 0.0 110.457 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.5 ttp -62.99 -28.11 69.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.377 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.2 mt -83.85 -34.55 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.259 -0.9 . . . . 0.0 110.29 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -87.26 -18.73 29.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.294 -0.879 . . . . 0.0 110.512 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -57.58 -23.7 52.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.238 -0.914 . . . . 0.0 110.38 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 141.23 -17.13 2.72 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.821 -1.311 . . . . 0.0 109.821 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -53.84 -66.6 0.36 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.237 -1.154 . . . . 0.0 110.333 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.513 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 4.0 mm? -106.44 165.15 11.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.488 -0.757 . . . . 0.0 110.058 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.3 p -59.59 169.34 1.34 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.432 -0.792 . . . . 0.0 110.273 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.8 mt -84.68 -24.45 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.384 -0.823 . . . . 0.0 110.158 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.4 m -58.91 -24.53 62.47 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.348 -0.845 . . . . 0.0 110.365 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -60.67 -35.88 77.35 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.31 -0.869 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.45 -36.34 80.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.75 -27.04 63.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.341 -0.849 . . . . 0.0 110.096 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 ttmt -82.95 -61.75 1.78 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.378 -0.826 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 61.7 t -48.05 -33.75 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.585 -0.697 . . . . 0.0 110.838 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttm-85 -45.98 -47.22 16.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.486 -0.759 . . . . 0.0 111.279 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -144.99 23.82 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.147 -0.971 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.591 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 1.1 tm-20 -81.82 -48.91 0.95 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.863 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.591 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.2 Cg_endo -75.99 169.88 21.23 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.127 1.067 . . . . 0.0 110.526 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.4 m -136.69 -41.97 0.61 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.404 -0.81 . . . . 0.0 110.139 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -100.2 -152.88 0.43 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.009 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.21 -7.65 48.23 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.222 -0.924 . . . . 0.0 110.66 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -55.72 -21.28 17.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.108 -0.995 . . . . 0.0 110.663 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -52.76 -32.46 43.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.25 -0.906 . . . . 0.0 110.557 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.426 ' O ' HD11 ' A' ' 57' ' ' ILE . . . -91.57 -11.67 36.6 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.299 -0.876 . . . . 0.0 110.524 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.65 -42.76 14.02 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.077 -1.014 . . . . 0.0 110.244 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -43.02 24.17 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.312 -0.867 . . . . 0.0 110.219 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.2 tp -60.15 -38.73 84.02 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.245 -0.91 . . . . 0.0 110.125 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.573 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.2 mp -76.51 -34.33 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.368 -0.833 . . . . 0.0 109.684 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -68.06 -38.11 82.06 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.323 -0.861 . . . . 0.0 109.641 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 mtt -59.88 -35.02 73.95 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.029 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -58.27 -52.33 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.396 -0.815 . . . . 0.0 110.036 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.415 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -75.18 -22.19 58.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.39 -0.819 . . . . 0.0 110.763 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.51 -27.36 63.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.252 -0.905 . . . . 0.0 110.585 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.5 tptt -70.8 -65.17 0.77 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.263 -0.898 . . . . 0.0 110.208 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -160.11 155.51 25.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.404 -0.81 . . . . 0.0 110.275 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.8 -28.19 65.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.464 -0.773 . . . . 0.0 110.125 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -62.41 -37.1 84.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.465 -0.772 . . . . 0.0 110.213 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.1 t -60.93 -33.22 72.82 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.294 -0.879 . . . . 0.0 110.174 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -64.86 -39.93 94.34 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.464 -0.772 . . . . 0.0 110.118 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.45 -31.79 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.335 -0.853 . . . . 0.0 110.074 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.6 t -70.61 -38.93 74.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.353 -0.842 . . . . 0.0 109.984 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.483 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 5.0 t80 -54.82 -38.19 67.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.385 -0.822 . . . . 0.0 109.818 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 28.0 t80 -65.08 -46.87 79.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.377 -0.827 . . . . 0.0 109.941 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -72.02 -25.95 62.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.369 -0.832 . . . . 0.0 110.42 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.32 -45.03 74.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 110.178 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.483 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 28.5 mt -68.56 -38.17 80.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.325 -0.859 . . . . 0.0 110.353 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.445 HD11 ' CD1' ' A' ' 72' ' ' TYR . 22.6 mt -66.38 -15.17 63.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.349 -0.844 . . . . 0.0 110.576 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -63.04 -22.81 67.11 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.214 -0.929 . . . . 0.0 110.549 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.49 -75.46 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.212 -0.93 . . . . 0.0 110.407 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.2 35.94 0.1 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.434 ' CD2' HD22 ' A' ' 75' ' ' LEU . 31.4 m-85 -95.28 16.2 17.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.995 . . . . 0.0 110.449 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HA ' ' CD2' ' A' ' 76' ' ' LEU . 11.9 ttpt -46.48 -30.58 2.26 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.392 -0.817 . . . . 0.0 110.973 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -62.09 -60.92 2.9 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.285 -0.884 . . . . 0.0 109.821 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.28 -43.8 66.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.442 -0.786 . . . . 0.0 109.992 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.27 -40.53 71.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.444 -0.785 . . . . 0.0 110.305 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.57 -35.17 75.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 12' ' ' HIS . 19.3 tp -61.69 -28.24 69.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.369 -0.832 . . . . 0.0 110.271 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.62 -39.52 18.58 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.31 -0.869 . . . . 0.0 110.429 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 48.5 t-80 -67.36 -47.8 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -69.59 -15.07 63.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.349 -0.844 . . . . 0.0 110.562 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -91.37 -16.38 53.23 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.528 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 18.7 mt -66.54 -53.77 27.56 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.159 -1.201 . . . . 0.0 110.436 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.528 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo . . . . . 0 C--N 1.313 -1.331 0 O-C-N 123.336 1.177 . . . . 0.0 110.706 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.155 0.502 . . . . 0.0 110.272 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -58.17 -50.46 73.46 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.317 -0.865 . . . . 0.0 110.269 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.21 -35.65 77.77 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.286 -0.884 . . . . 0.0 109.786 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 23.0 ttm-85 -68.42 -36.01 78.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.393 -0.817 . . . . 0.0 109.79 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -65.5 -32.86 74.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.473 -0.767 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.4 t -57.57 -59.83 4.58 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.312 -0.868 . . . . 0.0 110.082 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.449 ' CD2' ' CE1' ' A' ' 68' ' ' TYR . 1.4 tm? -59.33 -34.85 72.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.349 -0.844 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.5 mt -73.62 -28.0 61.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.367 -0.833 . . . . 0.0 110.054 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -93.66 1.98 56.45 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.42 -0.8 . . . . 0.0 110.567 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -98.15 28.99 3.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.155 -0.966 . . . . 0.0 109.696 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -71.01 -55.25 8.68 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.304 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.41 -34.58 75.6 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.2 -34.72 63.81 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.293 -0.879 . . . . 0.0 110.133 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 tt -77.16 -40.81 44.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.464 -0.773 . . . . 0.0 110.39 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.8 -41.88 62.04 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.28 -0.888 . . . . 0.0 110.405 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.6 ttpt -85.5 -32.0 22.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.343 -0.848 . . . . 0.0 110.548 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.419 ' HB3' ' CD1' ' A' ' 83' ' ' LEU . 70.6 m-20 -85.18 -65.53 1.0 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.879 . . . . 0.0 111.01 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 13.4 mm -114.58 122.33 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.23 -0.919 . . . . 0.0 110.569 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.553 ' O ' ' C ' ' A' ' 22' ' ' THR . 19.2 mtmm -113.75 141.89 46.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.631 -0.668 . . . . 0.0 109.23 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.553 ' C ' ' O ' ' A' ' 21' ' ' LYS . 74.0 p -24.1 97.53 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.652 -0.655 . . . . 0.0 111.149 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 24' ' ' TYR . 34.9 t -160.63 -176.75 5.74 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.487 -0.758 . . . . 0.0 110.557 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 23' ' ' SER . 8.1 t80 -33.57 -46.67 0.2 Allowed 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.899 -0.501 . . . . 0.0 112.168 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 38.6 mm -49.91 -64.67 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.06 -1.025 . . . . 0.0 110.527 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.437 ' O ' HG12 ' A' ' 30' ' ' ILE . 4.5 mmt -72.75 -53.5 11.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.345 -0.847 . . . . 0.0 110.367 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -46.64 -43.92 17.93 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.51 -0.744 . . . . 0.0 111.067 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 58.0 t60 -59.64 -37.35 78.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.119 -0.988 . . . . 0.0 109.846 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 29.9 mmt -80.26 -28.23 38.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.419 -0.801 . . . . 0.0 110.199 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 26' ' ' MET . 29.4 mm -64.41 -50.45 76.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.351 -0.843 . . . . 0.0 109.937 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.0 m -75.71 -19.74 58.87 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.348 -0.845 . . . . 0.0 110.483 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -24.07 47.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.164 -0.96 . . . . 0.0 110.358 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.47 -17.52 2.06 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.413 ' N ' ' CD1' ' A' ' 34' ' ' PHE . 12.6 m-30 -56.23 -72.33 0.08 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.217 -1.166 . . . . 0.0 110.451 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.519 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 4.0 mm? -106.47 161.82 14.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.293 -0.879 . . . . 0.0 110.227 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 p -70.67 162.5 28.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.403 -0.811 . . . . 0.0 110.095 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.0 mt -79.25 -29.13 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.287 -0.883 . . . . 0.0 110.06 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -61.97 -33.16 73.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.405 -0.809 . . . . 0.0 110.171 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -75.02 -26.74 59.71 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 110.316 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -74.0 -39.02 63.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.288 -0.882 . . . . 0.0 110.313 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -62.13 -35.93 80.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.296 -0.878 . . . . 0.0 110.261 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.401 ' O ' ' N ' ' A' ' 46' ' ' GLU . 16.0 tttt -72.29 -41.89 66.14 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.201 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.9 t -58.26 -34.47 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.344 -0.848 . . . . 0.0 110.38 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -55.87 -24.78 38.98 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.333 -0.854 . . . . 0.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -142.69 15.4 1.96 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.128 -0.982 . . . . 0.0 111.073 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.61 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 34.1 tt0 -81.85 -51.19 0.83 Allowed Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.017 -1.052 . . . . 0.0 110.585 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.61 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -76.61 170.2 20.37 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.201 1.106 . . . . 0.0 110.404 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.3 m -124.71 -39.04 2.32 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.36 -0.837 . . . . 0.0 110.274 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -104.31 -153.48 0.48 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.307 -0.871 . . . . 0.0 110.053 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -8.73 51.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.211 -0.931 . . . . 0.0 110.656 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -52.06 -24.97 7.56 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.114 -0.991 . . . . 0.0 110.65 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 24.2 ttp180 -52.95 -25.26 11.37 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.246 -0.909 . . . . 0.0 110.544 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.409 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -86.96 -26.32 23.89 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.309 -0.87 . . . . 0.0 110.315 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.82 -29.41 50.64 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 110.373 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.3 ttt -79.16 -52.47 8.13 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.304 -0.872 . . . . 0.0 110.481 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.1 tp -51.08 -35.06 33.03 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.375 -0.828 . . . . 0.0 110.95 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.567 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 0.8 OUTLIER -72.78 -32.19 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.219 -0.926 . . . . 0.0 110.265 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -70.87 -35.63 72.47 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 110.348 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.467 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -65.04 -29.49 70.39 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.229 -0.919 . . . . 0.0 110.141 179.672 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.74 -53.55 45.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.886 . . . . 0.0 109.684 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -73.67 -37.22 65.34 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt -60.34 -27.55 67.45 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.336 -0.853 . . . . 0.0 110.524 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -78.67 -64.66 1.12 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.154 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -160.2 153.89 22.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.351 -0.843 . . . . 0.0 110.207 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -74.96 -24.13 58.41 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.32 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -36.82 83.0 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.313 -0.867 . . . . 0.0 110.114 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.8 t -61.66 -31.47 71.59 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.468 -0.77 . . . . 0.0 110.061 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.449 ' CE1' ' CD2' ' A' ' 9' ' ' LEU . 8.7 t80 -68.2 -38.53 82.06 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.323 -0.861 . . . . 0.0 110.008 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.7 -42.54 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.345 -0.847 . . . . 0.0 110.105 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.8 t -62.96 -39.13 93.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.88 . . . . 0.0 109.938 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.442 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 1.8 t80 -53.25 -36.62 61.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.469 -0.77 . . . . 0.0 109.824 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.435 ' CD1' HD12 ' A' ' 76' ' ' LEU . 31.3 t80 -63.53 -45.91 88.39 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.308 -0.87 . . . . 0.0 110.075 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -75.98 -23.07 55.28 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.308 -0.87 . . . . 0.0 110.583 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.11 -33.99 75.53 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.176 -0.952 . . . . 0.0 110.403 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.442 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 4.3 mt -84.79 -33.69 22.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.34 -0.85 . . . . 0.0 110.432 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.435 HD12 ' CD1' ' A' ' 72' ' ' TYR . 26.6 mt -67.65 -14.93 63.37 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.375 -0.828 . . . . 0.0 110.584 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -66.51 -24.45 66.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.158 -0.964 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -103.26 -75.1 0.62 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.219 -0.926 . . . . 0.0 110.504 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.85 48.3 0.15 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -106.27 16.16 25.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.435 -1.038 . . . . 0.0 110.495 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -46.14 -32.74 3.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.387 -0.82 . . . . 0.0 110.735 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -68.63 -63.59 1.03 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 109.856 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.419 ' CD1' ' HB3' ' A' ' 19' ' ' ASP . 4.7 tt -62.79 -36.43 83.11 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.89 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.422 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -59.95 -36.69 77.62 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.469 -0.769 . . . . 0.0 110.044 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.23 -34.27 74.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.455 -0.778 . . . . 0.0 110.07 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.423 ' CD1' ' C ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.89 -47.48 84.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.451 -0.781 . . . . 0.0 109.926 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.1 -39.96 68.53 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.36 -0.838 . . . . 0.0 110.174 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.419 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 27.5 t-80 -62.42 -55.54 26.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.38 -0.825 . . . . 0.0 110.173 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.5 -24.78 61.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.806 . . . . 0.0 110.302 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -75.04 -14.44 81.81 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.543 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 7.9 mt -72.84 -57.64 3.02 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.211 -1.17 . . . . 0.0 110.328 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.543 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 47.1 Cg_endo . . . . . 0 C--N 1.314 -1.274 0 O-C-N 123.29 1.153 . . . . 0.0 110.467 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.716 0 CA-C-O 121.127 0.489 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -59.44 -37.44 78.12 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.399 -0.813 . . . . 0.0 110.212 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.21 -38.21 79.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.276 -0.89 . . . . 0.0 109.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.2 ttt180 -64.64 -31.93 73.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.381 -0.824 . . . . 0.0 109.778 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -75.68 -27.79 58.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.431 -0.793 . . . . 0.0 110.028 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.9 t -61.83 -60.44 3.64 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.319 -0.863 . . . . 0.0 110.168 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.406 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -53.33 -34.89 59.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.359 -0.838 . . . . 0.0 110.105 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 48.9 mt -79.97 -26.22 40.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.355 -0.84 . . . . 0.0 110.273 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -110.15 33.25 4.56 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.407 -0.808 . . . . 0.0 110.337 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.439 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.6 t-160 -146.39 43.54 1.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.331 -0.855 . . . . 0.0 110.081 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.3 ttp85 -75.36 -31.5 60.55 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.443 -0.786 . . . . 0.0 110.297 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.07 -34.43 70.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.225 -0.922 . . . . 0.0 110.402 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.439 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -84.93 -42.43 14.98 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.094 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.1 -37.37 86.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.385 -0.822 . . . . 0.0 110.19 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -76.09 -32.07 59.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.79 . . . . 0.0 110.073 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -64.78 -49.66 69.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.43 -0.794 . . . . 0.0 110.128 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -84.55 -55.72 3.98 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.381 -0.825 . . . . 0.0 110.066 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.405 ' CD1' HG13 ' A' ' 25' ' ' ILE . 14.9 mm -98.95 158.19 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.292 -0.88 . . . . 0.0 109.995 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.561 ' O ' ' C ' ' A' ' 22' ' ' THR . 50.9 mttt -154.14 141.52 19.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.477 -0.765 . . . . 0.0 109.481 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.561 ' C ' ' O ' ' A' ' 21' ' ' LYS . 67.9 p -24.63 96.5 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 121.47 0.652 . . . . 0.0 110.893 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 42.7 m -163.36 -175.84 4.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.548 -0.72 . . . . 0.0 110.157 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 11.2 t80 -33.08 -37.26 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.894 -0.504 . . . . 0.0 112.092 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.445 HD13 HG21 ' A' ' 25' ' ' ILE . 46.2 mm -54.63 -65.78 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.047 -1.033 . . . . 0.0 109.994 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -76.43 -34.47 58.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.349 -0.844 . . . . 0.0 110.374 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -57.32 -41.88 80.8 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.364 -0.835 . . . . 0.0 110.553 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -75.01 -50.37 16.76 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.308 -0.87 . . . . 0.0 110.37 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 mpp? -60.02 -50.33 74.14 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.338 -0.851 . . . . 0.0 110.437 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 98.6 mt -61.35 -28.66 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.459 -0.776 . . . . 0.0 110.297 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.0 m -90.32 -23.0 21.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.353 -0.842 . . . . 0.0 110.354 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -59.72 -21.48 60.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.332 -0.855 . . . . 0.0 110.421 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.24 -16.59 2.1 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -53.15 -71.56 0.07 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.147 -1.208 . . . . 0.0 110.247 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.512 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 4.0 mm? -108.12 164.12 12.57 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 109.908 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 p -62.53 144.33 56.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.376 -0.827 . . . . 0.0 110.197 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.5 mp -69.53 -22.97 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.24 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -57.02 -27.88 62.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.297 -0.877 . . . . 0.0 110.316 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -62.34 -37.46 85.72 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.38 -0.825 . . . . 0.0 110.077 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.55 -33.11 72.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.412 -0.805 . . . . 0.0 110.201 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -69.0 -31.13 69.73 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.316 -0.865 . . . . 0.0 110.229 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -84.87 -59.47 2.34 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 110.377 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.7 t -48.5 -33.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.501 -0.749 . . . . 0.0 110.786 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -44.97 -45.43 10.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.554 -0.716 . . . . 0.0 111.421 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -144.49 15.2 1.62 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.092 -1.005 . . . . 0.0 111.125 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.602 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 3.0 tm-20 -79.94 -48.09 1.38 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.116 -0.99 . . . . 0.0 110.891 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.602 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -75.49 166.78 27.94 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.121 1.063 . . . . 0.0 110.522 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.3 m -136.44 -42.93 0.62 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.438 -0.789 . . . . 0.0 110.174 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -96.2 -159.23 0.71 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.35 -0.844 . . . . 0.0 110.129 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -64.06 -14.58 55.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.313 -0.867 . . . . 0.0 110.641 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -55.96 -19.96 14.39 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.271 -0.893 . . . . 0.0 110.721 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -49.69 -49.68 46.7 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.342 -0.849 . . . . 0.0 110.496 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.428 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -75.27 -42.98 53.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.396 -0.815 . . . . 0.0 110.323 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.43 -34.06 4.41 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.254 -0.904 . . . . 0.0 110.801 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 19.0 ttt -85.03 -24.75 28.05 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.306 -0.872 . . . . 0.0 110.019 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.8 tp -82.01 -46.85 13.39 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.374 -0.828 . . . . 0.0 110.72 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.452 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.9 mp -68.63 -32.4 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.272 -0.893 . . . . 0.0 110.242 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp -71.04 -39.45 72.29 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.238 -0.914 . . . . 0.0 110.062 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.0 mmt -58.89 -29.24 66.87 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.355 -0.84 . . . . 0.0 110.338 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.9 mt -67.08 -59.9 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.368 -0.833 . . . . 0.0 110.078 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.406 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 1.7 mm? -69.25 -38.75 78.61 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.447 -0.783 . . . . 0.0 110.483 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -59.87 -25.37 65.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.323 -0.861 . . . . 0.0 110.387 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.9 tptp -73.54 -65.43 0.82 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.44 169.95 21.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 110.376 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -83.9 -26.09 29.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.769 . . . . 0.0 110.14 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.01 -40.78 98.8 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.369 -0.832 . . . . 0.0 110.008 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.4 t -60.06 -33.28 71.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.29 -0.881 . . . . 0.0 110.12 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -65.73 -40.96 92.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.39 -0.819 . . . . 0.0 109.892 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.2 -41.38 83.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.387 -0.821 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.2 t -64.11 -32.7 74.36 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.351 -0.843 . . . . 0.0 110.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -57.97 -42.19 84.52 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.4 -0.813 . . . . 0.0 109.89 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.439 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 36.3 t80 -62.6 -37.95 88.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.389 -0.82 . . . . 0.0 110.251 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -76.96 -32.93 57.63 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.463 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.58 -30.48 71.35 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 110.247 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.414 HD21 ' CD2' ' A' ' 80' ' ' TYR . 6.4 mt -84.98 -39.63 17.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.404 -0.81 . . . . 0.0 110.339 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.426 HD13 ' CD1' ' A' ' 72' ' ' TYR . 24.1 mt -68.85 -15.51 63.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.343 -0.848 . . . . 0.0 110.601 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.9 -21.1 64.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.267 -0.896 . . . . 0.0 110.622 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -109.66 -75.34 0.63 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.176 -0.952 . . . . 0.0 110.499 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.15 35.5 0.1 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.414 ' CD2' HD21 ' A' ' 75' ' ' LEU . 17.5 m-85 -98.35 16.43 21.59 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.378 -1.072 . . . . 0.0 110.438 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -44.98 -29.79 0.9 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -0.784 . . . . 0.0 110.831 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -73.64 -45.16 54.45 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 109.794 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -78.88 -40.19 33.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.505 -0.747 . . . . 0.0 109.861 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.423 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -65.24 -31.23 72.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.379 -0.826 . . . . 0.0 110.097 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.8 -34.87 76.24 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.45 -0.781 . . . . 0.0 110.21 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.9 tp -60.0 -45.76 91.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.382 -0.824 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -77.38 -24.59 50.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.349 -0.844 . . . . 0.0 110.441 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.439 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 33.2 t-80 -79.11 -42.51 26.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.264 -0.897 . . . . 0.0 110.488 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -60.76 -19.92 60.23 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.309 -0.87 . . . . 0.0 110.494 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -86.63 -19.26 56.94 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.574 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 78.7 mt -61.95 -51.14 77.43 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.187 -1.184 . . . . 0.0 110.728 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.574 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.6 Cg_endo . . . . . 0 C--N 1.315 -1.211 0 O-C-N 123.116 1.061 . . . . 0.0 110.635 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 121.135 0.493 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -60.25 -31.62 70.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.253 -0.904 . . . . 0.0 110.391 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.73 -39.3 67.0 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.351 -0.843 . . . . 0.0 110.07 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.7 ttt-85 -69.08 -26.28 64.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.514 -0.741 . . . . 0.0 110.187 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -76.08 -31.5 58.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.5 t -60.79 -56.3 22.81 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.371 -0.83 . . . . 0.0 110.173 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.31 -38.76 69.1 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.349 -0.844 . . . . 0.0 110.176 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.12 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.374 -0.829 . . . . 0.0 110.178 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -108.21 7.64 27.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.36 -0.837 . . . . 0.0 110.59 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.466 ' CE1' ' HG ' ' A' ' 86' ' ' LEU . 23.3 t-160 -103.86 32.35 3.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.171 -0.956 . . . . 0.0 109.92 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -75.06 -24.81 58.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.473 -0.767 . . . . 0.0 110.465 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -53.63 -35.74 61.28 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.194 -0.942 . . . . 0.0 110.379 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.406 ' HB2' ' NE2' ' A' ' 12' ' ' HIS . . . -85.83 -51.59 6.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.404 -0.81 . . . . 0.0 110.038 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.4 tp -57.44 -30.05 64.69 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 110.255 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -85.4 -33.16 22.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.435 -0.791 . . . . 0.0 110.371 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -67.5 -57.08 7.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.361 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -81.76 -65.2 1.04 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 110.391 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.8 mm -79.27 162.4 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.287 -0.883 . . . . 0.0 110.18 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.571 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.9 mttt -156.28 141.2 17.18 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.571 ' C ' ' O ' ' A' ' 21' ' ' LYS . 62.8 p -24.97 96.2 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.692 -0.63 . . . . 0.0 110.849 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.433 ' N ' ' O ' ' A' ' 21' ' ' LYS . 23.1 m -163.19 -175.96 4.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.617 -0.677 . . . . 0.0 110.304 -178.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.431 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.0 t80 -32.79 -40.56 0.05 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.831 -0.543 . . . . 0.0 112.176 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 41.5 mm -57.3 -65.71 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 120.918 -1.114 . . . . 0.0 110.029 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 10.5 mtm -75.86 -37.4 58.99 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.385 -0.822 . . . . 0.0 110.073 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -57.88 -50.54 73.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.428 -0.795 . . . . 0.0 110.358 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -55.59 -37.87 68.67 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.317 -0.864 . . . . 0.0 110.101 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.7 mtp -63.23 -38.43 91.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.409 -0.807 . . . . 0.0 110.131 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 93.7 mt -61.87 -36.61 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.029 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.4 m -92.83 -19.78 21.37 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.301 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -56.22 -24.78 44.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.312 -0.868 . . . . 0.0 110.301 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.22 -12.34 3.82 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.408 ' CD1' ' HB2' ' A' ' 67' ' ' SER . 24.0 m-85 -67.53 -58.29 4.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.12 -1.224 . . . . 0.0 110.297 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.499 ' CD2' ' N ' ' A' ' 35' ' ' LEU . 3.9 mm? -109.58 165.14 11.89 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.326 -0.859 . . . . 0.0 110.225 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 42.8 p -65.14 163.56 14.77 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.079 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.1 mt -84.83 -27.87 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.284 -0.885 . . . . 0.0 110.177 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.5 m -62.35 -25.45 67.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.357 -0.839 . . . . 0.0 110.261 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.49 -29.31 65.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.833 . . . . 0.0 110.243 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.31 -53.89 52.19 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.326 -0.859 . . . . 0.0 110.25 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -59.63 -25.55 64.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.316 -0.865 . . . . 0.0 110.199 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -76.46 -64.54 1.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.331 -0.856 . . . . 0.0 110.159 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 59.1 t -49.88 -33.65 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.493 -0.754 . . . . 0.0 110.699 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -42.13 -38.9 1.82 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.631 -0.668 . . . . 0.0 111.728 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -145.26 21.82 1.54 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.998 -1.064 . . . . 0.0 111.183 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.425 ' N ' ' HD2' ' A' ' 47' ' ' PRO . 2.2 tm-20 -79.02 -55.62 0.92 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 120.993 -1.067 . . . . 0.0 110.423 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 46' ' ' GLU . 50.3 Cg_endo -75.67 170.05 21.01 Favored 'Trans proline' 0 C--N 1.313 -1.327 0 O-C-N 123.545 1.287 . . . . 0.0 110.553 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.6 m -136.51 -40.07 0.64 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 110.358 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -95.27 -161.76 0.89 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.851 . . . . 0.0 110.311 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -61.11 -16.63 46.26 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 110.64 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -56.7 -19.07 14.72 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.221 -0.924 . . . . 0.0 110.674 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -50.6 -64.95 0.65 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.266 -0.897 . . . . 0.0 110.65 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.472 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -61.98 -51.88 66.28 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -44.35 -46.37 9.31 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.483 -0.76 . . . . 0.0 111.091 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.6 tpt -67.01 -28.48 68.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.097 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -81.93 -35.58 28.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.326 -0.859 . . . . 0.0 110.71 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 53' ' ' ALA . 3.3 mm -60.49 -36.27 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.216 -0.927 . . . . 0.0 110.504 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.1 mttp -70.1 -46.35 65.02 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.276 -0.89 . . . . 0.0 110.675 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 0.438 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.3 OUTLIER -56.2 -24.92 44.96 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.166 -0.958 . . . . 0.0 110.652 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.3 mt -69.71 -57.48 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.229 -0.919 . . . . 0.0 109.68 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -78.06 -35.52 49.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.563 -0.711 . . . . 0.0 110.854 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.73 -26.27 65.5 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -65.04 0.73 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.289 -0.882 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -160.1 169.12 24.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.253 -0.904 . . . . 0.0 110.268 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -82.92 -26.4 31.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.39 -0.819 . . . . 0.0 110.237 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -63.66 -39.48 94.45 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 110.24 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.408 ' HB2' ' CD1' ' A' ' 34' ' ' PHE . 12.1 t -60.54 -31.27 70.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.286 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.425 ' CE2' HG12 ' A' ' 91' ' ' ILE . 1.9 t80 -62.99 -43.03 99.92 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.371 -0.831 . . . . 0.0 109.957 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.46 -37.15 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.0 t -67.47 -35.2 78.72 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.323 -0.861 . . . . 0.0 109.968 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.415 ' CE2' HD22 ' A' ' 87' ' ' LEU . 6.3 t80 -59.26 -29.9 67.89 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.41 -0.806 . . . . 0.0 109.8 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -70.35 -49.84 45.17 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.366 -0.834 . . . . 0.0 110.239 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -73.81 -29.36 62.12 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.341 -0.849 . . . . 0.0 110.452 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.31 76.77 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.339 -0.851 . . . . 0.0 110.281 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.3 mt -84.15 -36.37 22.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.376 -0.828 . . . . 0.0 110.28 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.6 mt -67.43 -14.83 63.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.404 -0.81 . . . . 0.0 110.54 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -54.35 -24.0 17.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.272 -0.892 . . . . 0.0 110.69 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.64 -75.05 0.61 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.271 -0.893 . . . . 0.0 110.174 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.36 55.17 0.18 Allowed Glycine 0 N--CA 1.492 2.406 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -107.5 16.17 24.09 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -1.059 . . . . 0.0 110.575 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -47.35 -34.96 7.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.274 -0.891 . . . . 0.0 110.77 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -48.99 36.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.362 -0.836 . . . . 0.0 109.86 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 tt -69.37 -49.89 51.26 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 109.991 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.69 -28.33 69.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.461 -0.774 . . . . 0.0 110.171 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.83 -42.29 93.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.835 . . . . 0.0 110.195 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.466 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 48.1 tp -65.39 -30.79 71.64 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.371 -0.831 . . . . 0.0 110.191 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.415 HD22 ' CE2' ' A' ' 71' ' ' PHE . 1.1 mt -81.82 -27.89 33.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.399 -0.813 . . . . 0.0 110.109 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -77.53 -45.97 23.81 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.421 -0.8 . . . . 0.0 110.284 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.17 -19.96 65.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.355 -0.841 . . . . 0.0 110.328 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -81.01 -17.35 72.49 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.52 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 27.8 mt -65.62 -54.67 28.4 Favored Pre-proline 0 N--CA 1.493 1.69 0 O-C-N 121.19 -1.183 . . . . 0.0 110.68 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.52 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 45.2 Cg_endo . . . . . 0 C--N 1.314 -1.258 0 O-C-N 123.331 1.174 . . . . 0.0 110.684 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.081 0.467 . . . . 0.0 110.296 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -58.76 -41.88 87.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.305 -0.872 . . . . 0.0 110.265 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.91 91.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.34 -0.85 . . . . 0.0 110.087 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -64.15 -39.51 94.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.381 -0.825 . . . . 0.0 110.013 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -70.76 -27.55 64.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.405 -0.809 . . . . 0.0 110.032 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 t -62.08 -59.42 5.1 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.398 -0.814 . . . . 0.0 110.149 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.421 ' CD2' ' CE1' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -52.51 -35.68 53.65 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.311 -0.868 . . . . 0.0 109.987 179.732 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 mt -80.75 -21.52 40.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.36 -0.837 . . . . 0.0 110.53 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -115.45 24.57 11.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.923 . . . . 0.0 110.483 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.422 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 8.2 t-80 -130.95 34.07 4.11 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.303 -0.873 . . . . 0.0 110.12 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.4 ttp-105 -71.27 -25.17 62.34 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.363 -0.836 . . . . 0.0 110.256 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.14 -34.14 69.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.238 -0.914 . . . . 0.0 110.158 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.422 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -77.95 -44.56 26.5 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.431 -0.793 . . . . 0.0 110.038 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.28 -38.68 91.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.308 -0.87 . . . . 0.0 110.201 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.58 -42.99 79.61 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.324 -0.86 . . . . 0.0 110.12 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -81.75 -24.31 36.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.367 -0.833 . . . . 0.0 110.028 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -81.16 -64.86 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.285 -0.884 . . . . 0.0 110.179 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.4 ' CG2' ' N ' ' A' ' 21' ' ' LYS . 19.9 mt -128.59 163.17 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 0.0 110.404 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.56 ' O ' ' C ' ' A' ' 22' ' ' THR . 9.2 mttt -125.48 142.41 51.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.616 -0.677 . . . . 0.0 109.383 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.56 ' C ' ' O ' ' A' ' 21' ' ' LYS . 66.7 p -24.05 98.37 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.549 0.69 . . . . 0.0 111.075 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' TYR . 40.0 m -155.85 -175.81 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.638 . . . . 0.0 110.036 -178.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -33.01 -36.47 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.895 -0.503 . . . . 0.0 112.039 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.42 ' N ' ' O ' ' A' ' 23' ' ' SER . 42.9 mm -54.61 -65.17 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 120.99 -1.069 . . . . 0.0 110.221 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.41 -35.85 60.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.349 -0.845 . . . . 0.0 110.436 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.18 -48.96 77.73 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.34 -0.85 . . . . 0.0 110.564 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -55.86 -40.5 73.0 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.224 -0.923 . . . . 0.0 110.509 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -61.36 -50.27 73.57 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.328 -0.858 . . . . 0.0 110.237 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.1 mt -58.97 -25.52 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.392 -0.817 . . . . 0.0 110.418 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.3 m -96.89 -14.69 21.63 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.355 -0.841 . . . . 0.0 110.573 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -74.98 -3.0 29.75 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.238 -0.914 . . . . 0.0 110.771 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.15 8.17 7.36 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.409 ' CD1' ' O ' ' A' ' 29' ' ' MET . 19.2 m-85 -80.38 -70.36 0.53 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.115 -1.227 . . . . 0.0 110.376 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.499 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 3.9 mm? -108.67 164.64 12.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.387 -0.82 . . . . 0.0 110.04 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.4 p -60.83 158.66 12.56 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.324 -0.86 . . . . 0.0 110.146 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -73.91 -28.15 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.364 -0.835 . . . . 0.0 110.136 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -59.96 -30.19 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.197 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.31 -26.85 63.97 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.387 -0.821 . . . . 0.0 110.212 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -68.39 -35.18 77.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.33 -0.856 . . . . 0.0 110.156 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -69.91 -30.63 68.1 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.388 -0.82 . . . . 0.0 110.075 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -66.62 -63.5 1.06 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 110.131 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 65.0 t -47.14 -33.56 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.45 -0.781 . . . . 0.0 110.644 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -46.55 -47.55 19.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.54 -0.725 . . . . 0.0 111.369 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -145.07 13.98 1.47 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.064 -1.022 . . . . 0.0 111.309 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.621 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 15.6 tp10 -80.59 -47.64 1.23 Allowed Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.043 -1.036 . . . . 0.0 110.974 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.621 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.7 Cg_endo -76.45 169.95 20.9 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.128 1.067 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.1 m -141.13 -46.8 0.39 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.372 -0.83 . . . . 0.0 110.169 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.76 -160.2 0.47 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.288 -0.882 . . . . 0.0 110.175 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -7.55 50.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.26 -0.9 . . . . 0.0 110.453 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -61.39 -17.12 52.59 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.157 -0.964 . . . . 0.0 110.447 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -50.22 -59.61 3.78 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.244 -0.91 . . . . 0.0 110.387 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.414 ' O ' ' CD1' ' A' ' 57' ' ' ILE . . . -66.08 -48.06 72.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.347 -0.846 . . . . 0.0 110.001 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -49.25 -34.07 14.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.421 -0.799 . . . . 0.0 110.487 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.9 ttt -79.55 -25.14 41.73 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.429 -0.794 . . . . 0.0 109.974 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.16 -49.18 12.98 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.336 -0.853 . . . . 0.0 110.105 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.414 ' CD1' ' O ' ' A' ' 53' ' ' ALA . 2.5 mp -56.8 -30.9 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.318 -0.864 . . . . 0.0 109.997 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -75.15 -43.36 52.89 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.345 -0.847 . . . . 0.0 110.191 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 17.3 mmt -58.46 -30.96 67.35 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.419 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.18 -58.0 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.02 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -68.66 -40.34 80.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.375 -0.828 . . . . 0.0 110.502 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -55.58 -24.97 35.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.309 -0.869 . . . . 0.0 110.572 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -63.95 0.96 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.277 -0.89 . . . . 0.0 110.263 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -160.07 167.97 26.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.295 -0.878 . . . . 0.0 110.272 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -76.61 -36.46 57.46 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.17 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.37 -28.49 69.27 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.332 -0.855 . . . . 0.0 110.124 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.1 t -59.82 -48.58 81.11 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.38 -0.825 . . . . 0.0 110.139 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.421 ' CE1' ' CD2' ' A' ' 9' ' ' LEU . 4.0 t80 -57.71 -32.35 67.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.414 -0.804 . . . . 0.0 110.179 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.57 -44.09 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.333 -0.855 . . . . 0.0 109.939 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.4 t -65.51 -32.66 74.39 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.388 -0.82 . . . . 0.0 110.002 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -55.66 -41.54 73.79 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.339 -0.851 . . . . 0.0 109.857 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.428 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 38.4 t80 -62.71 -43.28 99.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.31 -0.869 . . . . 0.0 110.112 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -70.49 -24.83 62.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 110.404 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.88 -52.33 37.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.26 -0.9 . . . . 0.0 110.326 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.415 HD22 ' CG ' ' A' ' 80' ' ' TYR . 9.1 mt -62.72 -38.54 90.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.345 -0.847 . . . . 0.0 110.264 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.421 HD13 ' CD1' ' A' ' 72' ' ' TYR . 34.1 mt -66.91 -15.17 63.49 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.398 -0.814 . . . . 0.0 110.457 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.25 -22.93 66.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.25 -0.906 . . . . 0.0 110.478 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.69 -75.17 0.64 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.205 -0.935 . . . . 0.0 110.374 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.53 36.9 0.11 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.415 ' CG ' HD22 ' A' ' 75' ' ' LEU . 28.5 m-85 -92.9 16.38 12.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.493 -1.004 . . . . 0.0 110.441 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -42.4 -30.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.413 -0.804 . . . . 0.0 111.034 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -78.83 -48.86 13.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.314 -0.866 . . . . 0.0 109.913 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.71 -48.59 37.54 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.013 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.52 -34.71 72.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.387 -0.82 . . . . 0.0 110.139 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.3 -36.1 77.12 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.358 -0.839 . . . . 0.0 110.082 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 39.3 tp -61.88 -40.32 95.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.302 -0.874 . . . . 0.0 110.327 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -74.95 -30.04 61.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.359 -0.838 . . . . 0.0 110.276 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.428 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 5.6 t60 -84.97 -27.03 26.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.472 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.75 -23.19 42.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.318 -0.864 . . . . 0.0 110.31 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -80.41 -24.96 58.02 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.525 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.5 mt -59.63 -56.08 39.4 Favored Pre-proline 0 N--CA 1.493 1.685 0 O-C-N 121.189 -1.183 . . . . 0.0 110.45 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.525 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo . . . . . 0 C--N 1.313 -1.307 0 O-C-N 123.274 1.144 . . . . 0.0 110.705 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.137 0.494 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 ttmm -59.99 -34.98 74.05 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.349 -0.844 . . . . 0.0 110.552 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.43 82.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.234 -0.916 . . . . 0.0 110.139 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -64.77 -31.75 73.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.333 -0.854 . . . . 0.0 109.997 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -74.88 -27.65 60.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.427 -0.796 . . . . 0.0 109.818 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 t -62.01 -50.65 71.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.431 -0.793 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.409 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 2.1 tm? -59.38 -38.48 80.62 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.35 -0.844 . . . . 0.0 109.871 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.0 mt -72.5 -30.69 64.73 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.334 -0.854 . . . . 0.0 110.147 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -81.97 -4.66 57.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.348 -0.845 . . . . 0.0 110.639 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.45 ' CD2' ' CB ' ' A' ' 15' ' ' ALA . 9.7 t-160 -96.38 34.01 1.69 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.233 -0.917 . . . . 0.0 110.25 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -75.8 -41.57 52.43 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.846 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.28 -35.67 27.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.208 -0.933 . . . . 0.0 110.953 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.45 ' CB ' ' CD2' ' A' ' 12' ' ' HIS . . . -75.13 -25.85 58.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.077 -1.015 . . . . 0.0 110.267 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.432 ' N ' ' CD2' ' A' ' 12' ' ' HIS . 7.1 tt -85.28 -29.28 24.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.87 . . . . 0.0 109.831 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.69 -38.19 86.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 ttmt -84.34 -31.54 24.74 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 110.345 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.411 ' CB ' HD23 ' A' ' 83' ' ' LEU . 59.1 m-20 -84.46 -65.54 1.0 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.312 -0.867 . . . . 0.0 110.364 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.2 mm -108.99 109.56 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.388 -0.82 . . . . 0.0 110.224 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.559 ' O ' ' C ' ' A' ' 22' ' ' THR . 34.3 mtpt -100.56 141.4 33.47 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.509 -0.744 . . . . 0.0 109.438 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.559 ' C ' ' O ' ' A' ' 21' ' ' LYS . 73.2 p -25.02 97.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.302 0 CA-C-O 121.49 0.662 . . . . 0.0 111.122 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 7.8 t -160.34 -176.25 5.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.473 -0.767 . . . . 0.0 110.285 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 9.2 t80 -33.28 -39.25 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.859 -0.526 . . . . 0.0 111.866 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 46.2 mm -57.74 -64.1 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.044 -1.035 . . . . 0.0 110.029 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 7.5 mmt -75.23 -34.36 61.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.323 -0.861 . . . . 0.0 110.198 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -59.38 4.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.456 -0.777 . . . . 0.0 110.402 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 0.426 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . 11.4 t-80 -54.52 -24.92 22.75 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.329 -0.857 . . . . 0.0 110.474 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.41 ' O ' ' CD2' ' A' ' 34' ' ' PHE . 33.8 mtt -72.41 -38.58 68.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -0.909 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.5 mt -61.39 -50.18 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.248 -0.908 . . . . 0.0 110.049 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.8 m -74.76 -15.57 60.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 110.455 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.45 -25.49 50.84 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.276 -0.89 . . . . 0.0 110.431 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 139.45 -13.72 3.22 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.41 ' CD2' ' O ' ' A' ' 29' ' ' MET . 17.4 m-30 -58.56 -61.83 2.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.14 -1.212 . . . . 0.0 110.44 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp -125.46 165.19 18.89 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.264 -0.897 . . . . 0.0 110.423 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 p -57.23 173.53 0.24 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.446 -0.784 . . . . 0.0 110.397 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.3 mp -85.35 -21.44 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.424 -0.797 . . . . 0.0 110.201 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.9 m -57.91 -27.21 63.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.279 -0.888 . . . . 0.0 110.315 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.391 -0.818 . . . . 0.0 110.149 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -62.12 -32.26 72.81 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.361 -0.837 . . . . 0.0 110.114 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.84 -32.13 69.06 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.391 -0.818 . . . . 0.0 110.167 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -75.58 -54.94 6.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.06 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.6 t -53.36 -33.85 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.379 -0.826 . . . . 0.0 110.47 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -46.7 -36.57 7.29 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.378 -0.826 . . . . 0.0 110.878 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -144.17 20.8 1.75 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.282 -0.886 . . . . 0.0 110.543 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.501 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.7 tt0 -81.91 -57.02 0.53 Allowed Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 0.0 110.741 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 46.7 Cg_endo -72.49 170.09 20.19 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 O-C-N 123.307 1.162 . . . . 0.0 110.631 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 27.0 m -140.79 -43.03 0.39 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.436 -0.79 . . . . 0.0 110.1 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -98.33 -154.35 0.46 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.443 -0.786 . . . . 0.0 110.055 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -66.61 -12.55 58.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.281 -0.887 . . . . 0.0 110.609 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -57.47 -19.29 23.27 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.246 -0.909 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -51.62 -36.41 45.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.275 -0.89 . . . . 0.0 110.715 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.405 ' O ' HD11 ' A' ' 57' ' ' ILE . . . -85.98 -18.0 33.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 110.528 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -83.34 -34.49 25.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.179 -0.95 . . . . 0.0 110.287 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -77.52 -47.78 18.69 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.342 -0.849 . . . . 0.0 110.427 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.7 tp -55.76 -40.76 73.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.355 -0.84 . . . . 0.0 110.548 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.564 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 0.9 OUTLIER -67.88 -26.4 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.337 -0.852 . . . . 0.0 109.957 179.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.3 mtmm -70.9 -48.76 51.92 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.233 -0.917 . . . . 0.0 109.924 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -30.52 33.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.295 -0.878 . . . . 0.0 110.447 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 85.1 mt -63.88 -53.01 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.329 -0.857 . . . . 0.0 109.873 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.409 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.7 mm? -82.17 -27.31 32.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.458 -0.776 . . . . 0.0 110.699 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -60.74 -29.59 69.48 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.385 -0.822 . . . . 0.0 110.529 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -76.01 -65.07 0.96 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.24 -0.913 . . . . 0.0 110.389 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.28 169.99 22.05 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 0.0 110.218 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -80.58 -21.68 41.44 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.37 -0.831 . . . . 0.0 110.312 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -61.06 -39.37 89.59 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.18 -0.95 . . . . 0.0 110.232 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.4 t -60.11 -28.41 67.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.333 -0.854 . . . . 0.0 110.139 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -70.4 -35.83 73.7 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 109.954 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.59 -41.68 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.118 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.3 t -63.73 -36.84 85.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.299 -0.876 . . . . 0.0 110.182 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.466 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 5.9 t80 -57.05 -38.3 73.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.398 -0.814 . . . . 0.0 110.175 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 35.2 t80 -64.23 -43.33 95.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 110.372 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -76.84 -25.4 53.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.366 -0.834 . . . . 0.0 110.477 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.19 -35.84 80.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.284 -0.885 . . . . 0.0 110.45 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.466 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 11.6 mt -80.22 -40.98 26.02 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.428 HD11 ' CE1' ' A' ' 72' ' ' TYR . 39.2 mt -66.58 -14.97 63.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.712 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -63.71 -22.78 67.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.244 -0.91 . . . . 0.0 110.547 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -109.91 -75.27 0.63 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.207 -0.933 . . . . 0.0 110.459 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.04 37.0 0.1 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -94.45 16.47 15.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.506 -0.996 . . . . 0.0 110.588 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -41.49 -32.39 0.33 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.483 -0.761 . . . . 0.0 110.929 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -67.35 -47.42 70.49 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.344 -0.848 . . . . 0.0 109.63 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.411 HD23 ' CB ' ' A' ' 19' ' ' ASP . 1.1 tm? -69.94 -51.42 32.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.47 -0.769 . . . . 0.0 109.829 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.26 -30.04 69.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.44 -0.787 . . . . 0.0 110.202 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.35 86.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.32 -0.863 . . . . 0.0 110.124 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 12' ' ' HIS . 0.7 OUTLIER -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.356 -0.84 . . . . 0.0 110.173 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.34 -34.48 72.7 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.318 -0.864 . . . . 0.0 110.214 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.434 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 13.9 t-80 -77.87 -16.63 58.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.348 -0.845 . . . . 0.0 110.493 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.15 -14.97 45.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.293 -0.879 . . . . 0.0 110.545 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -109.58 -22.82 6.53 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.517 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 19.3 mt -59.93 -57.39 27.12 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.198 -1.177 . . . . 0.0 110.437 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.517 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.2 Cg_endo . . . . . 0 C--N 1.313 -1.322 0 O-C-N 123.267 1.14 . . . . 0.0 110.564 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.73 0 CA-C-O 121.238 0.542 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -58.16 -41.02 82.92 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.381 -0.824 . . . . 0.0 110.301 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.0 -41.18 82.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.335 -0.853 . . . . 0.0 110.091 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -66.82 -32.87 74.43 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.365 -0.834 . . . . 0.0 110.07 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -75.23 -27.78 59.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.344 -0.848 . . . . 0.0 110.283 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.3 t -60.68 -58.35 8.84 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.261 -0.899 . . . . 0.0 110.111 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.417 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -57.58 -34.71 69.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.379 -0.826 . . . . 0.0 110.046 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.1 mt -81.27 -21.2 39.56 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.343 -0.848 . . . . 0.0 110.471 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -116.66 53.67 0.88 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.306 -0.871 . . . . 0.0 110.427 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.431 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.5 t-160 -159.78 42.37 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.333 -0.854 . . . . 0.0 109.772 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.15 -33.78 61.55 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.474 -0.766 . . . . 0.0 110.565 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -58.99 -35.49 73.31 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.217 -0.927 . . . . 0.0 110.23 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.431 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -85.43 -34.98 21.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.433 -0.792 . . . . 0.0 110.141 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.412 ' CD1' ' C ' ' A' ' 16' ' ' LEU . 3.0 tm? -64.1 -46.41 84.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.387 -0.821 . . . . 0.0 109.871 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -61.65 -43.52 98.7 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.492 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -66.11 -42.29 89.41 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.362 -0.836 . . . . 0.0 110.524 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -80.28 -64.87 1.09 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.398 -0.814 . . . . 0.0 110.277 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.9 mm -102.79 166.26 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.313 -0.867 . . . . 0.0 110.203 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.536 ' O ' ' C ' ' A' ' 22' ' ' THR . 38.9 mtmt -153.64 141.14 19.8 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.46 -0.775 . . . . 0.0 109.531 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.536 ' C ' ' O ' ' A' ' 21' ' ' LYS . 70.7 p -25.85 94.65 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 121.455 0.645 . . . . 0.0 111.175 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 21' ' ' LYS . 26.5 m -165.23 -175.85 3.82 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.632 -0.667 . . . . 0.0 109.923 -178.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.44 ' C ' ' O ' ' A' ' 23' ' ' SER . 7.9 t80 -33.66 -34.72 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.883 -0.511 . . . . 0.0 111.841 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 23' ' ' SER . 44.2 mm -53.49 -65.46 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.063 -1.023 . . . . 0.0 110.027 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -75.78 -37.9 58.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.23 -0.918 . . . . 0.0 110.216 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -57.65 -50.37 73.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.7 -33.17 69.88 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.247 -0.908 . . . . 0.0 110.075 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.0 mtt -68.41 -58.08 4.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.512 -0.742 . . . . 0.0 110.008 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.3 mt -56.47 -27.33 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.392 -0.817 . . . . 0.0 110.07 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 33.5 m -88.67 -22.62 23.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.344 -0.847 . . . . 0.0 110.261 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -59.76 -26.82 66.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.328 -0.858 . . . . 0.0 110.33 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.64 -15.2 2.91 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -57.82 -47.67 81.95 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -1.175 . . . . 0.0 110.35 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.7 mp -132.07 165.13 24.7 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.347 -0.845 . . . . 0.0 110.387 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -70.43 171.85 9.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.39 -0.819 . . . . 0.0 110.265 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 49.4 mm -84.96 -18.77 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.824 . . . . 0.0 110.35 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.0 m -55.79 -26.25 45.21 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.24 -0.912 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -73.64 -28.03 61.57 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -71.56 -41.69 68.75 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.363 -0.835 . . . . 0.0 110.246 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -64.15 -27.69 69.25 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.32 -0.862 . . . . 0.0 110.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -80.19 -60.98 2.12 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.173 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 65.3 t -48.41 -33.85 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.442 -0.787 . . . . 0.0 110.668 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -46.62 -42.72 16.61 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.464 -0.772 . . . . 0.0 111.173 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -145.22 17.25 1.54 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.114 -0.991 . . . . 0.0 110.974 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.613 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.1 OUTLIER -79.55 -47.66 1.5 Allowed Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.048 -1.033 . . . . 0.0 110.721 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.613 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -77.13 170.08 20.31 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.262 1.138 . . . . 0.0 110.334 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.8 m -129.25 -41.46 1.4 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.386 -0.821 . . . . 0.0 110.355 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -98.41 -159.61 0.75 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.355 -0.84 . . . . 0.0 110.363 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -65.74 -12.13 51.35 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.369 -0.832 . . . . 0.0 110.715 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -55.63 -20.03 12.43 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.152 -0.967 . . . . 0.0 110.678 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 24.3 ttp180 -49.65 -37.43 28.28 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.177 -0.952 . . . . 0.0 110.592 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.1 -53.04 7.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.367 -0.833 . . . . 0.0 110.113 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -50.45 -26.47 5.12 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.44 -0.788 . . . . 0.0 110.619 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.8 tpt -82.99 -28.04 29.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.318 -0.864 . . . . 0.0 110.241 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.0 tp -84.89 -50.85 7.17 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.399 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.7 mp -58.93 -36.66 62.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.328 -0.858 . . . . 0.0 110.072 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -66.56 -37.53 85.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.323 -0.861 . . . . 0.0 109.929 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.7 mmt -61.27 -27.79 68.71 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.413 -0.804 . . . . 0.0 110.14 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.0 mt -66.72 -53.62 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.354 -0.841 . . . . 0.0 109.889 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.417 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -77.47 -34.06 54.45 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.51 -0.744 . . . . 0.0 110.535 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -25.08 67.5 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.279 -0.888 . . . . 0.0 110.339 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -77.35 -64.51 1.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 110.355 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -153.6 166.49 32.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.388 -0.82 . . . . 0.0 110.371 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -85.21 -25.33 27.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.8 . . . . 0.0 110.246 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.48 -35.25 71.9 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.338 -0.851 . . . . 0.0 110.382 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.8 t -64.45 -34.07 77.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.354 -0.841 . . . . 0.0 110.127 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -60.58 -44.89 95.71 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.4 -0.812 . . . . 0.0 110.023 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.15 -34.29 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.804 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.8 t -73.58 -29.43 62.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.41 -0.806 . . . . 0.0 109.978 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.454 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 10.4 t80 -57.47 -44.54 84.93 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.499 -0.751 . . . . 0.0 109.771 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 46.3 t80 -61.05 -45.79 93.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.459 -0.776 . . . . 0.0 110.072 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -76.42 -23.58 53.99 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.351 -0.843 . . . . 0.0 110.577 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.89 -32.01 70.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.454 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 3.9 mt -84.9 -39.23 18.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.204 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.404 HD12 ' CE1' ' A' ' 72' ' ' TYR . 23.0 mt -67.2 -14.73 63.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.408 -0.808 . . . . 0.0 110.524 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 -56.78 -24.75 52.65 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.0 110.643 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -116.78 -75.08 0.58 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.167 -0.958 . . . . 0.0 110.394 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.37 67.35 0.14 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -125.08 16.37 8.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.406 -1.056 . . . . 0.0 110.509 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ttmt -44.34 -30.93 0.91 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.473 -0.767 . . . . 0.0 110.96 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.61 -49.12 67.34 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.355 -0.841 . . . . 0.0 109.791 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -78.84 -40.49 32.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.427 -0.795 . . . . 0.0 109.798 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.37 -45.91 91.83 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.1 -29.21 70.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.334 -0.854 . . . . 0.0 110.07 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 23.2 tp -59.99 -50.19 74.72 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.446 -0.783 . . . . 0.0 110.212 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 mp -77.4 -25.3 50.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.258 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 2.0 t60 -68.74 -41.11 79.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.303 -0.873 . . . . 0.0 110.359 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.62 -22.19 64.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.259 -0.901 . . . . 0.0 110.543 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -84.9 -19.71 59.03 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.521 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.8 mt -60.67 -53.91 59.83 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.171 -1.193 . . . . 0.0 110.576 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.521 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.4 Cg_endo . . . . . 0 C--N 1.313 -1.317 0 O-C-N 123.271 1.143 . . . . 0.0 110.547 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.051 0.453 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -55.08 -34.64 63.78 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.283 -0.886 . . . . 0.0 110.379 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.56 -39.04 92.38 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -63.8 -30.24 71.36 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.388 -0.82 . . . . 0.0 109.851 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -72.82 -37.14 67.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.493 -0.754 . . . . 0.0 109.959 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.8 t -63.27 -50.18 71.15 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.374 -0.829 . . . . 0.0 110.156 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -60.18 -36.58 77.92 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.277 -0.889 . . . . 0.0 109.913 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.9 mt -68.23 -31.04 70.25 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.85 . . . . 0.0 109.961 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -97.07 22.9 7.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.403 -0.81 . . . . 0.0 110.16 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.431 ' CE1' ' HG ' ' A' ' 87' ' ' LEU . 6.8 t60 -107.97 23.25 14.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.898 . . . . 0.0 110.331 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.1 ttp180 -67.94 -47.5 68.53 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.232 -0.917 . . . . 0.0 110.003 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.71 -35.38 77.88 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.362 -0.836 . . . . 0.0 110.111 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 0.416 ' HB2' ' CD2' ' A' ' 12' ' ' HIS . . . -78.81 -43.87 24.37 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.399 -0.813 . . . . 0.0 110.074 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.46 ' C ' ' CD1' ' A' ' 16' ' ' LEU . 2.3 tm? -59.09 -50.36 74.36 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.296 -0.878 . . . . 0.0 109.692 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.91 -54.07 51.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.335 -0.853 . . . . 0.0 110.225 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -61.84 -27.55 68.86 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.29 -0.881 . . . . 0.0 110.167 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.406 ' HB3' ' CD1' ' A' ' 83' ' ' LEU . 63.6 m-20 -85.1 -65.19 1.04 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.41 -0.806 . . . . 0.0 110.317 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.435 ' CD1' HG13 ' A' ' 25' ' ' ILE . 22.1 mt -134.38 147.12 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.307 -0.87 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.58 ' O ' ' C ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -106.44 141.98 36.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.562 -0.711 . . . . 0.0 109.298 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.58 ' C ' ' O ' ' A' ' 21' ' ' LYS . 81.8 p -24.17 98.49 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.493 0.663 . . . . 0.0 110.891 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 24' ' ' TYR . 3.3 m -152.22 -175.68 5.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.69 -0.631 . . . . 0.0 110.183 -178.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.425 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -32.91 -37.43 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.896 -0.503 . . . . 0.0 112.064 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.435 HG13 ' CD1' ' A' ' 20' ' ' ILE . 44.3 mm -52.45 -65.25 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.901 -1.125 . . . . 0.0 110.169 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 0.42 ' O ' HG12 ' A' ' 30' ' ' ILE . 2.1 mpt? -75.16 -50.49 16.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.891 . . . . 0.0 110.392 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -47.44 -51.53 19.86 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.526 -0.734 . . . . 0.0 111.228 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -55.26 -40.09 70.56 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.193 -0.942 . . . . 0.0 110.181 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 42.9 mtp -68.11 -32.52 72.87 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.398 -0.814 . . . . 0.0 110.433 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 26' ' ' MET . 39.7 mm -61.94 -65.43 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.34 -0.85 . . . . 0.0 110.405 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.2 m -59.94 -19.27 51.0 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.426 -0.796 . . . . 0.0 110.691 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -22.37 32.29 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.18 -0.95 . . . . 0.0 110.407 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.86 -14.53 3.35 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.43 ' N ' ' CD1' ' A' ' 34' ' ' PHE . 15.0 m-30 -60.91 -67.76 0.37 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.177 -1.19 . . . . 0.0 110.441 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 0.48 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 3.8 mm? -113.25 150.05 32.94 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 110.251 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.8 p -62.58 175.18 0.83 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.393 -0.817 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.7 mp -77.68 -15.64 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.426 -0.797 . . . . 0.0 110.497 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.3 m -61.77 -31.25 71.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.236 -0.915 . . . . 0.0 110.415 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -70.92 -31.05 67.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.329 -0.857 . . . . 0.0 110.274 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -75.16 -27.67 59.81 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.34 -0.85 . . . . 0.0 110.433 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.76 -35.53 77.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.183 -0.948 . . . . 0.0 110.362 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -77.7 -59.75 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.228 -0.92 . . . . 0.0 110.265 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 78.8 t -47.42 -33.44 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.406 -0.809 . . . . 0.0 110.593 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -46.67 -53.17 12.22 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.588 -0.695 . . . . 0.0 111.505 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.82 4.75 2.57 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.05 -1.031 . . . . 0.0 111.645 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.56 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.9 tp10 -75.2 -47.49 4.49 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 120.917 -1.115 . . . . 0.0 110.884 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.0 Cg_endo -74.84 169.99 21.36 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.189 1.099 . . . . 0.0 110.455 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -152.65 -50.37 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.376 -0.827 . . . . 0.0 110.103 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.05 -160.71 0.3 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.379 -0.826 . . . . 0.0 110.076 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -66.76 -13.82 61.87 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.417 -0.802 . . . . 0.0 110.501 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -62.76 -16.29 57.18 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.494 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -51.82 -60.66 2.91 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.249 -0.907 . . . . 0.0 110.518 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.426 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -72.7 -48.37 39.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.324 -0.86 . . . . 0.0 110.299 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.76 -35.53 6.27 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.434 -0.791 . . . . 0.0 110.781 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -82.05 -25.02 34.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.364 -0.835 . . . . 0.0 109.932 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.3 tp -80.17 -39.4 29.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 0.0 110.23 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.426 HG12 ' O ' ' A' ' 53' ' ' ALA . 32.7 mm -63.37 -38.74 82.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 109.933 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.74 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 109.74 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.7 mmt -59.43 -27.81 66.38 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.404 -0.81 . . . . 0.0 110.012 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.5 mt -66.99 -49.81 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.515 -0.741 . . . . 0.0 109.959 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -80.69 -29.21 36.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.475 -0.766 . . . . 0.0 110.635 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -61.28 -28.92 69.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.317 -0.864 . . . . 0.0 110.451 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -65.27 0.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.386 -0.821 . . . . 0.0 110.249 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -160.24 170.1 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.397 -0.815 . . . . 0.0 110.187 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -81.31 -28.87 34.41 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.382 -0.824 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -61.69 -36.85 82.08 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.351 -0.843 . . . . 0.0 110.251 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 t -59.8 -37.46 79.18 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -60.31 -36.29 77.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.328 -0.857 . . . . 0.0 109.862 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.7 t -65.23 -35.58 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.42 -0.8 . . . . 0.0 109.856 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.1 t -69.58 -37.11 76.83 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.401 -0.812 . . . . 0.0 110.046 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.431 ' CE1' HD11 ' A' ' 75' ' ' LEU . 21.5 t80 -52.41 -39.67 61.21 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.429 -0.795 . . . . 0.0 109.918 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -62.46 -51.95 65.48 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.996 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -72.68 -20.6 61.21 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.324 -0.86 . . . . 0.0 110.562 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.78 -41.28 83.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.26 -0.9 . . . . 0.0 110.368 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.431 HD11 ' CE1' ' A' ' 71' ' ' PHE . 2.1 mt -80.03 -35.72 36.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.326 -0.858 . . . . 0.0 110.196 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.2 mt -65.0 -15.55 62.42 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.391 -0.818 . . . . 0.0 110.389 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -58.19 -21.36 47.2 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.203 -0.935 . . . . 0.0 110.467 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -116.96 -75.05 0.58 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.337 -0.852 . . . . 0.0 110.288 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.59 67.74 0.12 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -125.14 16.39 8.44 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.409 -1.053 . . . . 0.0 110.565 -179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -45.0 -37.55 4.12 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.319 -0.863 . . . . 0.0 110.814 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.64 -44.54 77.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.279 -0.888 . . . . 0.0 109.734 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.406 ' CD1' ' HB3' ' A' ' 19' ' ' ASP . 4.2 tt -70.24 -53.88 15.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.454 -0.779 . . . . 0.0 109.796 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.75 -26.58 67.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.431 -0.793 . . . . 0.0 110.322 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.93 96.06 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.346 -0.846 . . . . 0.0 110.154 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.412 ' CD1' ' C ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.54 -43.13 99.42 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.363 -0.835 . . . . 0.0 109.852 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.431 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 0.9 OUTLIER -73.33 -34.16 65.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.401 -0.812 . . . . 0.0 110.296 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -70.01 -48.1 59.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.415 -0.803 . . . . 0.0 110.168 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.62 -18.93 61.48 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.361 -0.837 . . . . 0.0 110.405 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.45 -21.81 53.02 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.574 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 57.3 mt -59.26 -52.55 73.66 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.223 -1.163 . . . . 0.0 110.594 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.574 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.9 Cg_endo . . . . . 0 C--N 1.313 -1.293 0 O-C-N 123.328 1.173 . . . . 0.0 110.755 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 121.202 0.525 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.5 ttmt -51.08 -39.15 55.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.348 -0.845 . . . . 0.0 110.784 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -64.12 -41.23 97.32 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.242 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -67.39 -30.63 70.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.313 -0.867 . . . . 0.0 110.052 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -72.07 -27.43 62.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.375 -0.828 . . . . 0.0 110.062 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -63.21 -56.5 16.15 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.426 -0.796 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.06 -34.8 76.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.414 -0.804 . . . . 0.0 109.777 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.5 mt -65.79 -33.67 76.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.34 -0.85 . . . . 0.0 110.014 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -94.04 18.9 9.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.333 -0.854 . . . . 0.0 110.267 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.422 ' CG ' HD21 ' A' ' 87' ' ' LEU . 52.0 t60 -103.45 26.24 8.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.924 . . . . 0.0 110.055 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -75.07 -50.47 16.33 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 110.063 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.94 -33.78 70.99 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.379 -0.826 . . . . 0.0 110.307 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -46.97 26.25 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.359 -0.838 . . . . 0.0 110.058 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.44 -41.55 80.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.396 -0.815 . . . . 0.0 110.185 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.32 -45.4 76.33 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.34 -0.85 . . . . 0.0 110.454 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -85.2 -23.42 28.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.27 -0.893 . . . . 0.0 110.495 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.11 -65.24 0.87 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.303 -0.873 . . . . 0.0 110.419 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.1 mt -146.9 143.35 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.322 -0.862 . . . . 0.0 110.558 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.57 ' O ' ' C ' ' A' ' 22' ' ' THR . 8.4 mttt -94.78 142.57 27.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.589 -0.695 . . . . 0.0 109.162 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.57 ' C ' ' O ' ' A' ' 21' ' ' LYS . 80.9 p -23.5 97.58 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.618 -0.676 . . . . 0.0 110.921 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.2 t -146.32 -176.02 5.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.628 -0.67 . . . . 0.0 110.38 -178.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' SER . 13.8 t80 -33.15 -37.98 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.963 -0.46 . . . . 0.0 111.941 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.3 mm -57.5 -65.56 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.99 -1.069 . . . . 0.0 109.859 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 11.4 mmt -75.73 -25.27 56.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.459 -0.776 . . . . 0.0 110.323 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -71.15 -54.51 10.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.414 -0.804 . . . . 0.0 110.412 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.88 -32.62 63.86 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.292 -0.88 . . . . 0.0 110.378 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.8 mtp -62.48 -44.31 96.69 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 110.326 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.6 mt -63.82 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.397 -0.814 . . . . 0.0 110.199 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.4 m -79.53 -25.12 41.78 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.34 -0.85 . . . . 0.0 110.328 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.96 -20.72 55.05 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.242 -0.911 . . . . 0.0 110.363 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.07 -13.48 3.07 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -54.17 -66.6 0.37 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.207 -1.172 . . . . 0.0 110.4 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.3 mp -128.34 165.19 21.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.358 -0.839 . . . . 0.0 110.212 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.7 p -56.31 154.4 8.23 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.399 -0.813 . . . . 0.0 110.396 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.2 mp -77.16 -23.66 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.405 -0.81 . . . . 0.0 110.32 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.1 m -64.59 -37.34 87.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.384 -0.822 . . . . 0.0 110.169 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.1 -25.58 65.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.257 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -74.95 -31.88 61.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.302 -0.874 . . . . 0.0 110.412 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.76 -32.42 72.99 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.336 -0.853 . . . . 0.0 110.306 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.23 -40.09 78.13 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.363 -0.835 . . . . 0.0 110.11 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.9 t -59.36 -34.35 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.366 -0.834 . . . . 0.0 110.265 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.07 -30.75 6.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.502 -0.749 . . . . 0.0 111.04 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -145.2 20.25 1.57 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.218 -0.926 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.524 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 10.3 tt0 -79.92 -57.24 0.69 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.096 -1.003 . . . . 0.0 110.355 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.524 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 47.7 Cg_endo -72.99 170.26 20.21 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 O-C-N 123.347 1.183 . . . . 0.0 110.52 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.8 m -131.07 -41.8 1.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -87.85 -162.38 0.81 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.362 -0.836 . . . . 0.0 110.224 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -71.46 -9.18 57.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.337 -0.852 . . . . 0.0 110.568 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -60.25 -17.51 42.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.544 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -50.94 -49.53 59.61 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.213 -0.929 . . . . 0.0 110.683 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.434 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.79 -61.82 1.7 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.894 . . . . 0.0 110.512 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -48.85 -39.6 26.3 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.498 -0.751 . . . . 0.0 111.036 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 ttm -65.34 -45.2 85.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.8 tp -59.25 -34.84 72.7 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.362 -0.836 . . . . 0.0 110.714 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.434 HG12 ' O ' ' A' ' 53' ' ' ALA . 6.8 mm -61.19 -36.12 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 110.482 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -45.52 93.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.176 -0.953 . . . . 0.0 110.043 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.41 -28.86 46.62 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.287 -0.883 . . . . 0.0 110.463 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.414 ' CD1' ' HA ' ' A' ' 57' ' ' ILE . 86.6 mt -65.82 -54.69 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.39 -0.819 . . . . 0.0 109.841 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -79.35 -30.31 42.59 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.468 -0.77 . . . . 0.0 110.715 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -58.96 -25.01 63.16 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.284 -0.885 . . . . 0.0 110.611 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -72.61 -65.29 0.81 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.312 -0.868 . . . . 0.0 110.367 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -160.25 170.12 21.79 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.271 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -75.47 -29.81 59.71 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.371 -0.831 . . . . 0.0 110.128 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -62.84 -33.75 75.89 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.357 -0.839 . . . . 0.0 110.309 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 t -60.2 -26.85 66.69 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.37 -0.831 . . . . 0.0 110.159 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -75.86 -37.62 58.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.415 -0.803 . . . . 0.0 110.111 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -70.5 -37.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.895 . . . . 0.0 110.164 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.0 t -69.04 -37.66 78.69 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.324 -0.86 . . . . 0.0 110.279 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -54.99 -40.77 70.43 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.266 -0.896 . . . . 0.0 109.879 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 29.1 t80 -61.71 -38.94 89.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.308 -0.87 . . . . 0.0 109.947 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -78.27 -23.8 47.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.388 -0.82 . . . . 0.0 110.482 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.2 81.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.265 -0.897 . . . . 0.0 110.367 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 80' ' ' TYR . 32.0 mt -77.78 -37.33 49.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.344 -0.847 . . . . 0.0 110.114 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 39.6 mt -65.84 -15.05 62.54 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.453 -0.78 . . . . 0.0 110.467 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -63.4 -31.85 73.12 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -100.75 -75.68 0.58 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.26 -0.9 . . . . 0.0 110.519 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.26 35.31 0.1 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.415 ' CD2' HD22 ' A' ' 75' ' ' LEU . 18.6 m-85 -94.71 16.01 16.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.445 -1.032 . . . . 0.0 110.484 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -47.79 -31.36 4.81 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.342 -0.849 . . . . 0.0 110.677 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.62 -54.47 23.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.405 -0.809 . . . . 0.0 109.807 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 tt -73.22 -41.19 64.02 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.411 -0.806 . . . . 0.0 109.928 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.93 82.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.42 -0.8 . . . . 0.0 109.924 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.25 -35.18 76.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.389 -0.82 . . . . 0.0 110.126 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.39 -42.22 91.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.331 -0.856 . . . . 0.0 110.23 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.422 HD21 ' CG ' ' A' ' 12' ' ' HIS . 0.9 OUTLIER -71.41 -42.81 67.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.409 -0.807 . . . . 0.0 110.232 -179.949 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.41 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 21.1 t60 -66.03 -32.92 74.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.385 -0.822 . . . . 0.0 110.305 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.19 -14.84 63.29 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.372 -0.83 . . . . 0.0 110.587 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -108.55 -3.73 32.59 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 19.3 mt -67.49 -54.98 15.97 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.046 -1.267 . . . . 0.0 110.375 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo . . . . . 0 C--N 1.313 -1.329 0 O-C-N 123.319 1.168 . . . . 0.0 110.65 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.074 0.464 . . . . 0.0 110.289 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.3 tttp -64.78 -43.93 91.65 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 110.291 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.63 85.45 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -62.53 -46.32 88.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.331 -0.856 . . . . 0.0 109.747 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -25.48 67.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.775 . . . . 0.0 110.125 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.5 t -58.77 -59.28 5.67 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.4 ' CD1' HG21 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -60.29 -38.49 83.77 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.383 -0.823 . . . . 0.0 109.82 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 28.9 mt -63.24 -29.33 70.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.723 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -99.66 14.74 29.05 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.541 -0.725 . . . . 0.0 110.257 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.418 ' CD2' HD21 ' A' ' 87' ' ' LEU . 60.2 t60 -97.83 25.49 5.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.243 -0.91 . . . . 0.0 110.171 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 ttp-105 -72.31 -50.05 29.89 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.426 -0.796 . . . . 0.0 110.104 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -63.13 -27.05 69.12 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.29 -45.48 12.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.321 -0.862 . . . . 0.0 110.322 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.426 ' CD1' ' C ' ' A' ' 16' ' ' LEU . 2.8 tm? -64.32 -48.4 75.76 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.277 -0.889 . . . . 0.0 109.735 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -64.58 -33.27 75.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.369 -0.832 . . . . 0.0 110.125 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -82.93 -27.32 30.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.344 -0.848 . . . . 0.0 110.123 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -84.2 -63.65 1.3 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -0.831 . . . . 0.0 110.145 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 27.3 mt -136.11 109.78 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.605 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.564 ' O ' ' C ' ' A' ' 22' ' ' THR . 6.6 mttt -62.15 142.69 57.48 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.353 -0.842 . . . . 0.0 109.241 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.564 ' C ' ' O ' ' A' ' 21' ' ' LYS . 11.7 p -23.62 97.64 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.677 0.751 . . . . 0.0 111.29 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 17.9 t -141.98 -176.28 4.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.665 -0.647 . . . . 0.0 110.316 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 16.4 t80 -33.42 -38.05 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.899 -0.5 . . . . 0.0 111.842 -179.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.439 HD12 HG23 ' A' ' 25' ' ' ILE . 43.3 mm -58.87 -60.17 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.024 -1.047 . . . . 0.0 109.948 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 7.9 mmt -75.35 -28.04 59.43 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.324 -0.86 . . . . 0.0 110.233 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -74.78 -60.46 2.27 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.324 -0.86 . . . . 0.0 110.51 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -58.35 -25.78 62.38 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.386 -0.821 . . . . 0.0 110.624 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 ttt -70.6 -49.56 46.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.31 -0.869 . . . . 0.0 110.389 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.2 mt -60.01 -31.24 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.304 -0.872 . . . . 0.0 110.152 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 24.7 m -77.91 -14.98 59.36 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.434 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.07 -25.44 45.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.219 -0.926 . . . . 0.0 110.468 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.16 -11.48 3.85 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 67' ' ' SER . 23.1 m-85 -58.43 -58.63 7.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.125 -1.22 . . . . 0.0 110.308 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mp -116.04 163.3 16.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.361 -0.837 . . . . 0.0 110.217 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -59.74 148.16 35.23 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.378 -0.826 . . . . 0.0 110.41 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 71.9 mt -69.75 -20.6 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.431 -0.793 . . . . 0.0 110.239 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -58.02 -27.35 63.46 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.306 -0.871 . . . . 0.0 110.28 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -67.14 -33.77 76.14 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 110.128 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -59.81 -37.5 79.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.361 -0.837 . . . . 0.0 110.206 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -68.68 -30.22 68.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.347 -0.846 . . . . 0.0 110.101 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -76.42 -57.86 3.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.388 -0.82 . . . . 0.0 110.048 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 66.8 t -48.99 -33.92 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.409 -0.807 . . . . 0.0 110.647 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -48.83 -40.93 31.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.456 -0.777 . . . . 0.0 111.312 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -145.22 18.59 1.56 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.117 -0.989 . . . . 0.0 111.178 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.607 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -81.1 -48.49 1.07 Allowed Pre-proline 0 N--CA 1.493 1.698 0 O-C-N 121.021 -1.049 . . . . 0.0 110.71 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.607 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.7 Cg_endo -77.0 170.15 20.32 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 O-C-N 123.182 1.096 . . . . 0.0 110.291 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -134.16 -46.52 0.77 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.321 -0.862 . . . . 0.0 110.135 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -90.14 -155.34 0.37 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.09 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -76.38 -3.28 36.12 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.254 -0.904 . . . . 0.0 110.674 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -59.91 -17.56 38.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.129 -0.982 . . . . 0.0 110.553 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -51.55 -43.51 62.38 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.29 -0.881 . . . . 0.0 110.621 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.23 -7.69 57.62 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.277 -0.89 . . . . 0.0 110.599 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.02 -45.01 12.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.07 -1.019 . . . . 0.0 110.021 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.0 tpp -76.44 -33.39 58.76 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.38 -0.825 . . . . 0.0 109.912 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.17 -44.07 97.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.445 -0.784 . . . . 0.0 109.878 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.551 ' N ' ' CD1' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -64.17 -45.89 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.388 -0.82 . . . . 0.0 109.73 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.8 mttp -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.298 -0.876 . . . . 0.0 109.855 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.8 mmt -59.84 -35.37 74.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.301 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.87 -52.77 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.401 -0.812 . . . . 0.0 110.121 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.28 -36.23 58.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.334 -0.854 . . . . 0.0 110.705 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -25.5 59.45 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.247 -0.908 . . . . 0.0 110.606 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -84.98 -64.94 1.07 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.87 165.22 34.7 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.266 -0.896 . . . . 0.0 110.226 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -85.13 -22.09 28.99 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.481 -0.762 . . . . 0.0 110.318 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -56.48 -32.79 65.35 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.429 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 21.7 t -73.14 -32.44 64.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.381 -0.824 . . . . 0.0 110.154 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.445 ' CE2' ' CD1' ' A' ' 91' ' ' ILE . 9.3 t80 -63.55 -46.46 85.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.02 -43.91 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.019 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -62.53 -36.37 82.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.363 -0.836 . . . . 0.0 110.111 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -53.58 -36.85 62.37 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.327 -0.858 . . . . 0.0 109.693 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.445 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 28.7 t80 -63.68 -43.27 97.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.436 -0.79 . . . . 0.0 109.827 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -76.56 -27.45 55.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.391 -0.818 . . . . 0.0 110.375 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.66 -51.49 69.15 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.287 -0.883 . . . . 0.0 110.26 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 68.3 mt -65.7 -38.78 90.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.422 -0.799 . . . . 0.0 110.239 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.415 HD12 ' CE1' ' A' ' 72' ' ' TYR . 58.6 mt -67.01 -14.99 63.44 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.347 -0.845 . . . . 0.0 110.482 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -56.94 -25.08 57.05 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.219 -0.925 . . . . 0.0 110.479 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.68 -75.01 0.61 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.314 -0.866 . . . . 0.0 110.375 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.71 60.43 0.15 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -114.36 16.32 17.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -1.04 . . . . 0.0 110.504 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -44.84 -30.05 0.91 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.39 -0.818 . . . . 0.0 110.781 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -67.84 -60.24 2.67 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.319 -0.863 . . . . 0.0 109.732 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.77 -37.47 76.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.371 -0.831 . . . . 0.0 109.892 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.09 -29.58 70.42 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.378 -0.826 . . . . 0.0 110.039 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.15 71.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.431 -0.793 . . . . 0.0 110.014 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 0.411 ' CD1' ' C ' ' A' ' 86' ' ' LEU . 1.7 tm? -59.16 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.33 -0.857 . . . . 0.0 109.656 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.418 HD21 ' CD2' ' A' ' 12' ' ' HIS . 1.1 mt -72.61 -37.96 67.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.39 -0.819 . . . . 0.0 110.176 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 21.6 t-160 -60.73 -51.03 71.08 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.407 -0.808 . . . . 0.0 110.258 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.55 -20.01 52.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.325 -0.859 . . . . 0.0 110.326 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.51 2.13 70.13 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.601 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 8.6 mm -76.87 -57.94 1.12 Allowed Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.027 -1.278 . . . . 0.0 110.142 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.601 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.5 Cg_endo . . . . . 0 C--N 1.314 -1.256 0 O-C-N 123.207 1.109 . . . . 0.0 110.434 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.168 0.508 . . . . 0.0 110.309 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 ttmm -51.92 -33.61 38.0 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.291 -0.881 . . . . 0.0 110.71 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.63 -36.33 80.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.227 -0.92 . . . . 0.0 110.139 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -69.83 -30.34 67.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.399 -0.813 . . . . 0.0 109.969 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -73.56 -28.92 62.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.394 -0.816 . . . . 0.0 110.172 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -62.56 -51.35 67.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 110.091 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.455 HD22 ' CE1' ' A' ' 68' ' ' TYR . 1.8 tm? -60.36 -34.64 74.15 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.344 -0.847 . . . . 0.0 109.843 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 53.4 mt -62.6 -30.21 71.17 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.357 -0.839 . . . . 0.0 109.958 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -91.58 13.16 18.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.365 -0.834 . . . . 0.0 110.457 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.403 ' CD2' ' HB2' ' A' ' 16' ' ' LEU . 42.7 t60 -96.02 22.34 7.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.283 -0.886 . . . . 0.0 110.2 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -75.35 -57.54 3.83 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.259 -0.901 . . . . 0.0 110.452 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.19 -35.12 73.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.375 -0.828 . . . . 0.0 110.49 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.49 -49.7 21.15 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.848 . . . . 0.0 110.166 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.403 ' HB2' ' CD2' ' A' ' 12' ' ' HIS . 7.8 tt -62.09 -32.44 72.99 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.404 -0.81 . . . . 0.0 110.255 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.01 -52.06 65.54 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.425 -0.797 . . . . 0.0 110.384 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -85.07 -25.16 27.75 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.336 -0.853 . . . . 0.0 110.48 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.406 ' HB3' ' CD1' ' A' ' 83' ' ' LEU . 78.9 m-20 -85.35 -65.39 1.02 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.238 -0.914 . . . . 0.0 110.773 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.9 mm -117.09 109.63 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.228 -0.92 . . . . 0.0 110.599 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.0 mttt -96.93 141.68 29.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.461 -0.774 . . . . 0.0 109.156 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.552 ' C ' ' O ' ' A' ' 21' ' ' LYS . 75.8 p -24.39 97.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.681 -0.637 . . . . 0.0 111.202 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 24' ' ' TYR . 41.8 t -156.78 -176.72 6.13 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.603 -0.685 . . . . 0.0 110.357 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.441 ' C ' ' O ' ' A' ' 23' ' ' SER . 14.8 t80 -33.63 -44.5 0.15 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.875 -0.515 . . . . 0.0 111.775 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.57 -52.59 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 120.963 -1.086 . . . . 0.0 109.893 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.9 mmt -75.38 -47.13 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.454 -0.779 . . . . 0.0 110.306 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.42 -62.17 2.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.421 -0.8 . . . . 0.0 110.793 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -53.01 -36.93 61.04 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.219 -0.926 . . . . 0.0 110.84 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 0.416 ' HG2' ' CE2' ' A' ' 34' ' ' PHE . 20.9 ttp -66.61 -42.82 86.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.278 -0.889 . . . . 0.0 110.342 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 67.5 mt -72.47 -47.31 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.288 -0.882 . . . . 0.0 110.183 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.4 m -63.04 -18.61 63.53 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.283 -0.886 . . . . 0.0 110.48 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.31 -20.04 39.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.193 -0.942 . . . . 0.0 110.535 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.75 -5.05 5.46 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.416 ' CE2' ' HG2' ' A' ' 29' ' ' MET . 7.4 m-30 -55.82 -54.89 39.04 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.136 -1.214 . . . . 0.0 110.395 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mp -129.07 165.11 21.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.365 -0.835 . . . . 0.0 110.077 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.9 p -56.85 145.17 30.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.378 -0.826 . . . . 0.0 110.492 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.4 mt -61.76 -23.89 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.432 -0.792 . . . . 0.0 110.28 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.9 m -59.36 -26.3 64.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.265 -0.897 . . . . 0.0 110.371 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.02 -46.64 83.56 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.273 -0.892 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.06 -32.43 73.8 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.398 -0.814 . . . . 0.0 110.157 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -64.89 -27.53 68.92 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt -84.85 -59.68 2.28 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.389 -0.82 . . . . 0.0 110.33 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.4 t -48.14 -33.89 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.432 -0.793 . . . . 0.0 110.758 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -47.82 -40.78 22.14 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.409 -0.807 . . . . 0.0 111.14 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.2 18.27 1.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.868 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.594 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.3 tm-20 -81.98 -48.16 0.95 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.108 -0.995 . . . . 0.0 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.4 Cg_endo -76.05 169.94 21.1 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.186 1.098 . . . . 0.0 110.359 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.5 m -128.6 -40.09 1.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 110.345 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -154.35 0.51 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.15 -12.59 41.31 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.25 -0.906 . . . . 0.0 110.83 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -51.75 -24.52 5.98 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.114 -0.991 . . . . 0.0 110.686 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -55.27 -40.13 70.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.26 -0.9 . . . . 0.0 110.322 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.424 ' O ' HD11 ' A' ' 57' ' ' ILE . . . -81.08 -11.54 59.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -0.874 . . . . 0.0 110.469 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.43 -47.76 9.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.988 . . . . 0.0 110.261 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.5 ttt -71.81 -37.85 70.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.84 . . . . 0.0 110.378 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.0 tp -60.36 -46.34 90.29 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.257 -0.902 . . . . 0.0 110.306 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.553 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.3 mp -72.51 -39.12 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.837 . . . . 0.0 109.987 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -64.49 -37.29 87.02 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.712 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.36 -31.35 70.24 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 109.939 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.77 -54.74 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.407 -0.808 . . . . 0.0 109.885 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.4 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 1.7 mm? -69.93 -27.69 64.97 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 110.601 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -67.68 -29.09 68.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.244 -0.91 . . . . 0.0 110.342 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -72.74 -64.97 0.85 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.257 -0.902 . . . . 0.0 110.235 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -160.09 166.7 29.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.391 -0.818 . . . . 0.0 110.182 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -81.05 -25.5 37.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.442 -0.786 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -62.27 -34.01 75.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.13 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -59.65 -37.93 80.06 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.376 -0.827 . . . . 0.0 110.012 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.455 ' CE1' HD22 ' A' ' 9' ' ' LEU . 10.4 t80 -66.39 -34.3 77.65 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 109.84 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.6 t -72.69 -40.46 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.0 110.05 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -67.06 -43.45 82.66 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.436 -0.79 . . . . 0.0 110.022 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.435 ' CE1' ' CD1' ' A' ' 75' ' ' LEU . 1.1 t80 -55.15 -29.89 58.72 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.38 -0.825 . . . . 0.0 109.789 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.443 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 26.9 t80 -67.57 -39.64 84.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.355 -0.841 . . . . 0.0 109.939 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -76.51 -34.52 58.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.414 -0.804 . . . . 0.0 110.308 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.8 -31.98 70.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.336 -0.853 . . . . 0.0 110.33 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.435 ' CD1' ' CE1' ' A' ' 71' ' ' PHE . 36.9 mt -82.88 -37.35 24.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.313 -0.867 . . . . 0.0 110.279 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.421 HD13 ' CE1' ' A' ' 72' ' ' TYR . 20.7 mt -70.13 -14.88 62.85 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.388 -0.82 . . . . 0.0 110.477 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -70.49 -23.1 62.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.098 -1.001 . . . . 0.0 110.742 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -106.26 -75.49 0.63 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.21 -0.931 . . . . 0.0 110.559 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.31 35.98 0.1 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 0.405 ' CG ' HD21 ' A' ' 75' ' ' LEU . 48.9 m-85 -100.46 16.04 25.91 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.502 -0.999 . . . . 0.0 110.51 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.4 tttt -46.75 -31.78 3.19 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.352 -0.843 . . . . 0.0 110.711 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -67.07 -51.57 52.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.87 . . . . 0.0 109.694 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.406 ' CD1' ' HB3' ' A' ' 19' ' ' ASP . 4.9 tt -71.14 -48.79 49.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 109.99 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.415 ' HB2' ' CD1' ' A' ' 72' ' ' TYR . . . -57.9 -34.92 70.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.417 -0.802 . . . . 0.0 110.312 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.75 -36.02 77.85 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.364 -0.835 . . . . 0.0 110.029 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 tt -62.43 -36.5 82.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.422 -0.799 . . . . 0.0 110.288 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -80.83 -29.87 35.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.367 -0.833 . . . . 0.0 110.351 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 57.1 t-80 -75.31 -55.21 5.93 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.393 -0.817 . . . . 0.0 110.494 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.16 -19.13 52.42 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.289 -0.882 . . . . 0.0 110.588 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.86 -22.82 48.2 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.527 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 16.7 mt -56.94 -53.76 61.6 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.269 -1.136 . . . . 0.0 110.684 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.527 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 46.1 Cg_endo . . . . . 0 C--N 1.312 -1.353 0 O-C-N 123.289 1.152 . . . . 0.0 110.735 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.094 0.473 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -49.44 -37.05 24.34 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.39 -0.819 . . . . 0.0 110.707 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.15 99.34 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.355 -0.84 . . . . 0.0 110.111 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.8 ttp85 -65.78 -32.88 74.66 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.348 -0.845 . . . . 0.0 110.126 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -75.4 -25.0 57.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.321 -0.862 . . . . 0.0 110.143 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -62.23 -50.41 71.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.271 -0.893 . . . . 0.0 110.123 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.464 ' CD2' ' CE1' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -64.81 -36.42 84.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.8 mt -68.73 -31.61 70.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.428 -0.795 . . . . 0.0 109.909 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -96.84 27.7 3.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.415 -0.803 . . . . 0.0 110.01 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.445 ' CG ' HD22 ' A' ' 87' ' ' LEU . 60.5 t60 -112.07 36.57 3.29 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.803 . . . . 0.0 110.079 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -75.07 -64.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.497 -0.752 . . . . 0.0 110.297 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.83 -27.64 69.02 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.387 -0.821 . . . . 0.0 110.221 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.86 -50.24 74.24 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 110.317 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 0.441 ' HB2' ' CD2' ' A' ' 12' ' ' HIS . 0.7 OUTLIER -75.09 -26.25 59.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 110.533 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.25 -46.06 54.57 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.264 -0.898 . . . . 0.0 110.64 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -85.25 -22.37 28.66 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.421 -0.799 . . . . 0.0 110.531 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . 69.5 m-20 -85.02 -64.99 1.06 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.701 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 20' ' ' ILE . 43.4 mt -131.4 164.87 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.154 -0.966 . . . . 0.0 111.045 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 0.581 ' O ' ' C ' ' A' ' 22' ' ' THR . 15.6 mmtp -131.84 142.86 49.83 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.581 ' C ' ' O ' ' A' ' 21' ' ' LYS . 71.9 p -23.15 96.03 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 121.641 0.734 . . . . 0.0 110.993 -179.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 0.456 ' O ' ' C ' ' A' ' 24' ' ' TYR . 65.2 p -155.84 -175.5 5.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.69 -0.631 . . . . 0.0 110.089 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 0.456 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.8 t80 -32.59 -40.68 0.05 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.751 -0.593 . . . . 0.0 111.805 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 42.5 mm -55.56 -60.5 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.94 -1.1 . . . . 0.0 109.541 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.53 -34.96 60.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.404 -0.81 . . . . 0.0 110.092 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -67.32 -61.33 1.97 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.392 -0.818 . . . . 0.0 110.375 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -53.02 -24.98 10.86 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.274 -0.891 . . . . 0.0 110.456 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.1 mmt -78.16 -34.37 49.74 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.341 -0.849 . . . . 0.0 110.226 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.1 mt -81.96 -43.5 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -66.8 -19.82 65.82 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.36 -0.837 . . . . 0.0 110.485 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.69 -20.29 47.22 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.262 -0.899 . . . . 0.0 110.436 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.96 -6.25 4.75 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 0.403 ' CD2' ' OG ' ' A' ' 67' ' ' SER . 8.7 m-30 -53.68 -58.41 7.3 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.102 -1.234 . . . . 0.0 110.454 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 mt -132.03 165.06 24.84 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.303 -0.873 . . . . 0.0 110.292 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.4 p -55.48 144.31 26.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.375 -0.828 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.8 mt -74.37 -25.33 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 110.116 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -59.26 -46.1 89.43 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.378 -0.826 . . . . 0.0 110.364 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.72 -32.78 74.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.342 -0.849 . . . . 0.0 110.119 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -63.27 -45.71 90.23 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.816 . . . . 0.0 110.049 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.76 -29.94 60.45 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.375 -0.828 . . . . 0.0 110.114 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 26.0 ttmt -62.86 -54.72 34.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.428 -0.795 . . . . 0.0 109.946 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.2 t -44.7 -33.73 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.572 -0.705 . . . . 0.0 110.557 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -49.24 -33.76 13.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.552 -0.717 . . . . 0.0 111.291 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -145.35 14.09 1.42 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.052 -1.03 . . . . 0.0 111.628 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 0.477 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 4.5 tm-20 -82.05 -48.61 0.92 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 120.878 -1.139 . . . . 0.0 110.959 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.477 ' CD ' ' N ' ' A' ' 46' ' ' GLU . 50.9 Cg_endo -77.97 160.19 30.46 Favored 'Trans proline' 0 C--N 1.314 -1.277 0 O-C-N 123.376 1.198 . . . . 0.0 110.709 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 49.3 m -126.87 -32.24 2.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.49 -0.756 . . . . 0.0 110.282 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.05 -164.07 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.32 -0.863 . . . . 0.0 110.202 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -19.06 21.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.327 -0.858 . . . . 0.0 110.628 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -52.49 -21.54 3.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.225 -0.922 . . . . 0.0 110.666 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -50.36 -65.27 0.59 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.297 -0.877 . . . . 0.0 110.649 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.08 -47.52 74.0 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.385 -0.822 . . . . 0.0 109.913 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.17 -33.56 41.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.354 -0.841 . . . . 0.0 110.394 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.3 ttt -81.31 -26.49 35.63 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.109 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.4 tt -73.05 -50.81 20.84 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.338 -0.851 . . . . 0.0 110.171 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 0.41 ' CG2' ' CD1' ' A' ' 9' ' ' LEU . 3.1 mp -62.56 -37.57 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.399 -0.813 . . . . 0.0 109.913 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -37.35 84.09 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.268 -0.895 . . . . 0.0 109.634 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 28.5 mmm -60.94 -30.18 70.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.825 . . . . 0.0 110.102 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 93.2 mt -62.32 -46.26 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.407 -0.808 . . . . 0.0 109.917 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.52 -28.64 62.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.438 -0.789 . . . . 0.0 110.547 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -40.16 94.63 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.5 tttm -61.38 -65.47 0.69 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.301 -0.874 . . . . 0.0 110.315 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.42 170.03 21.83 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.373 -0.829 . . . . 0.0 110.293 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -80.02 -30.12 39.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.383 -0.823 . . . . 0.0 110.142 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -62.38 -27.73 69.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.399 -0.813 . . . . 0.0 110.184 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.403 ' OG ' ' CD2' ' A' ' 34' ' ' PHE . 2.9 t -62.85 -39.47 94.5 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.394 -0.816 . . . . 0.0 110.085 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 0.464 ' CE1' ' CD2' ' A' ' 9' ' ' LEU . 5.5 t80 -62.08 -39.61 93.01 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.418 -0.801 . . . . 0.0 110.015 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 63.5 t -64.9 -41.77 93.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.316 -0.865 . . . . 0.0 109.964 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 38.4 t -63.06 -37.35 86.85 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.388 -0.82 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 0.441 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 6.5 t80 -54.18 -35.96 62.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.371 -0.83 . . . . 0.0 109.767 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.456 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 28.4 t80 -63.59 -45.82 88.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.419 -0.8 . . . . 0.0 110.078 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -28.45 65.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.256 -0.903 . . . . 0.0 110.296 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.88 -55.64 30.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.3 -0.875 . . . . 0.0 110.419 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 0.441 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 11.9 mt -60.72 -35.96 77.63 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.374 -0.829 . . . . 0.0 110.39 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.442 HD13 ' CD1' ' A' ' 72' ' ' TYR . 30.3 mt -71.71 -14.98 62.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.446 -0.784 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -59.71 -33.06 71.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.194 -0.941 . . . . 0.0 110.656 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -105.52 -75.37 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -0.918 . . . . 0.0 110.392 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.95 35.22 0.1 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -95.68 16.32 17.65 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.36 -1.083 . . . . 0.0 110.311 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -45.0 -29.45 0.84 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.412 -0.805 . . . . 0.0 110.863 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.55 -50.17 72.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.269 -0.894 . . . . 0.0 109.757 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.56 -41.79 59.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.38 -0.825 . . . . 0.0 109.587 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.84 -32.47 73.69 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 109.999 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.98 -34.61 78.49 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.91 -46.73 87.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.301 -0.874 . . . . 0.0 110.455 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 0.445 HD22 ' CG ' ' A' ' 12' ' ' HIS . 1.8 mp -74.86 -47.41 30.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.336 -0.853 . . . . 0.0 110.332 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 0.456 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 67.8 t60 -59.85 -44.12 94.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.38 -0.825 . . . . 0.0 110.516 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -58.23 -20.64 43.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.329 -0.857 . . . . 0.0 110.534 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -107.08 14.15 40.52 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 0.582 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 7.8 mm -74.08 -57.12 2.42 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.259 . . . . 0.0 109.984 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.582 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo . . . . . 0 C--N 1.314 -1.286 0 O-C-N 123.347 1.182 . . . . 0.0 110.476 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 1.015 ' HB3' ' CA ' ' A' ' 3' ' ' ALA . . . . . . . . 0 C--O 1.203 -1.353 0 CA-C-O 121.176 0.512 . . . . 1.32 110.335 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 1.607 ' HZ2' ' CD ' ' A' ' 4' ' ' LYS . 10.3 tttt -57.31 -37.56 72.67 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.424 -0.797 . . . . 2.59 110.491 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ALA . . . . . 1.009 ' HB1' ' CA ' ' A' ' 5' ' ' ALA . . . -62.48 -39.39 93.29 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.155 -0.966 . . . . 1.15 110.154 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ARG . . . . . 1.654 ' HE ' ' CZ ' ' A' ' 6' ' ' ARG . 68.5 ttt180 -66.43 -33.45 75.74 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.29 -0.881 . . . . 3.08 110.11 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ASN . . . . . 1.038 ' ND2' ' CB ' ' A' ' 7' ' ' ASN . 3.3 m-20 -72.82 -28.64 62.67 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.395 -0.816 . . . . 1.94 110.182 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 t -61.13 -55.13 36.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.418 -0.801 . . . . 1.11 110.249 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.969 HD21 ' CD2' ' A' ' 9' ' ' LEU . 1.2 tm? -59.24 -36.03 74.74 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.029 -1.044 . . . . 1.15 110.034 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' LEU . . . . . 1.034 HD22 ' CG ' ' A' ' 10' ' ' LEU . 66.5 mt -71.01 -28.72 64.62 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.42 -0.8 . . . . 1.32 110.242 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 1.178 ' NE2' ' CG ' ' A' ' 11' ' ' GLN . 55.1 tt0 -100.15 20.06 15.28 Favored 'General case' 0 C--O 1.171 -3.037 0 CA-C-O 121.526 0.679 . . . . 2.61 110.53 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' HIS . . . . . 0.587 ' NE2' ' CB ' ' A' ' 15' ' ' ALA . 3.6 t-160 -112.83 30.88 6.8 Favored 'General case' 0 C--N 1.262 -3.2 0 O-C-N 120.166 -1.584 . . . . 2.97 111.541 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . 1.594 HH21 ' CZ ' ' A' ' 13' ' ' ARG . 49.2 ttp180 -72.97 -43.92 61.69 Favored 'General case' 0 C--N 1.274 -2.679 0 O-C-N 121.292 -0.88 . . . . 2.84 110.929 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . 1.036 ' OE1' ' CG ' ' A' ' 14' ' ' GLU . 69.6 tt0 -62.25 -33.91 75.51 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.107 -0.995 . . . . 1.31 110.455 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ALA . . . . . 1.007 ' HB3' ' CA ' ' A' ' 15' ' ' ALA . . . -78.43 -42.9 28.73 Favored 'General case' 0 C--O 1.195 -1.798 0 O-C-N 121.231 -0.918 . . . . 1.21 110.59 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' LEU . . . . . 1.576 HD12 ' CG ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.19 -38.93 86.22 Favored 'General case' 0 C--N 1.29 -1.995 0 O-C-N 121.1 -1.0 . . . . 2.16 110.152 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 1.058 ' OE1' ' CG ' ' A' ' 17' ' ' GLU . 60.2 tt0 -60.22 -41.99 94.21 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.466 -0.771 . . . . 1.73 110.638 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LYS . . . . . 1.557 ' HZ2' ' CE ' ' A' ' 18' ' ' LYS . 80.3 tttt -78.11 -32.62 50.6 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.173 -0.954 . . . . 2.18 110.575 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . 1.012 ' OD1' ' CB ' ' A' ' 19' ' ' ASP . 65.9 m-20 -82.75 -63.7 1.32 Allowed 'General case' 0 C--N 1.272 -2.768 0 O-C-N 120.337 -1.477 . . . . 1.38 111.564 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ILE . . . . . 1.3 HD12 ' CG1' ' A' ' 20' ' ' ILE . 0.5 OUTLIER -119.39 136.45 56.52 Favored 'Isoleucine or valine' 1 C--O 1.102 -6.689 0 O-C-N 120.73 -1.231 . . . . 1.49 112.225 -179.883 . . . . . . . . 4 4 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . 1.632 ' HE3' ' CD ' ' A' ' 21' ' ' LYS . 88.5 mttt -112.85 141.99 46.03 Favored 'General case' 1 C--N 1.224 -4.851 0 O-C-N 116.772 -3.705 . . . . 2.48 109.125 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . 0.998 HG22 ' CB ' ' A' ' 22' ' ' THR . 75.7 p -24.2 97.41 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.505 0.669 . . . . 1.13 111.212 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' SER . . . . . 1.073 ' CB ' ' OG ' ' A' ' 23' ' ' SER . 0.4 OUTLIER -156.33 -176.21 5.84 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.409 -0.807 . . . . 1.45 110.233 -178.648 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TYR . . . . . 1.392 ' CZ ' ' CD2' ' A' ' 24' ' ' TYR . 12.8 t80 -33.23 -39.82 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.805 -0.559 . . . . 2.17 111.943 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ILE . . . . . 0.996 HD11 ' CG1' ' A' ' 25' ' ' ILE . 44.0 mm -55.74 -62.7 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 120.962 -1.086 . . . . 1.16 110.079 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' MET . . . . . 1.578 ' HE3' ' SD ' ' A' ' 26' ' ' MET . 1.6 mmt -75.54 -38.03 59.59 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.313 -0.867 . . . . 1.65 110.473 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ASP . . . . . 1.044 ' OD1' ' CB ' ' A' ' 27' ' ' ASP . 5.0 t70 -61.03 -53.87 51.87 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 120.89 -1.131 . . . . 1.18 110.705 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' HIS . . . . . 1.472 ' HD2' ' CG ' ' A' ' 28' ' ' HIS . 18.4 t-160 -57.05 -34.22 68.01 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.887 -1.133 . . . . 2.18 110.361 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' MET . . . . . 1.541 ' HE1' ' CG ' ' A' ' 29' ' ' MET . 2.8 mtt -68.51 -41.82 79.44 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 120.943 -1.098 . . . . 3.17 110.411 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ILE . . . . . 1.535 HD12 ' CG1' ' A' ' 30' ' ' ILE . 86.1 mt -64.15 -42.9 97.02 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.169 0 O-C-N 120.91 -1.119 . . . . 1.51 110.382 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.1 m -77.52 -18.81 56.66 Favored 'General case' 0 C--N 1.283 -2.32 0 O-C-N 120.496 -1.377 . . . . 0.93 110.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASP . . . . . 1.097 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 4.9 t70 -58.9 -22.85 60.28 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.087 -1.008 . . . . 1.32 110.453 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.82 -12.49 3.4 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.109 -1.196 . . . . 0.4 110.109 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PHE . . . . . 1.387 ' CZ ' ' CD1' ' A' ' 34' ' ' PHE . 12.7 m-30 -59.42 -61.51 2.57 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.851 -1.382 . . . . 2.2 110.37 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' LEU . . . . . 1.556 HD22 ' CG ' ' A' ' 35' ' ' LEU . 5.6 mp -119.39 162.93 17.98 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.214 -0.929 . . . . 1.95 110.558 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' THR . . . . . 1.056 HG21 ' CB ' ' A' ' 36' ' ' THR . 24.9 p -61.52 157.7 16.6 Favored 'General case' 0 C--O 1.199 -1.603 0 O-C-N 121.201 -0.937 . . . . 1.2 110.344 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ILE . . . . . 1.653 HD11 ' CG1' ' A' ' 37' ' ' ILE . 11.3 mt -75.97 -22.36 15.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.2 0 O-C-N 120.807 -1.183 . . . . 1.74 110.459 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 m -59.17 -30.05 67.9 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.308 -0.87 . . . . 0.97 110.456 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -67.07 -31.9 72.71 Favored 'General case' 0 C--N 1.283 -2.308 0 O-C-N 121.176 -0.952 . . . . 1.78 110.712 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 1.163 ' CD ' ' CB ' ' A' ' 40' ' ' GLU . 7.4 tt0 -65.89 -38.8 89.71 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.956 0.884 . . . . 2.32 110.406 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' GLU . . . . . 1.127 ' OE2' ' CG ' ' A' ' 41' ' ' GLU . 32.5 tt0 -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.277 -2.576 0 O-C-N 120.946 -1.096 . . . . 1.75 110.692 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 1.486 ' HZ1' ' CE ' ' A' ' 42' ' ' LYS . 10.5 ttmt -75.99 -56.95 4.18 Favored 'General case' 0 C--N 1.283 -2.311 0 O-C-N 120.903 -1.123 . . . . 2.06 110.407 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' VAL . . . . . 0.985 HG11 ' CB ' ' A' ' 43' ' ' VAL . 83.0 t -50.12 -33.78 9.99 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.495 -0.753 . . . . 1.2 110.638 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -47.38 -40.4 17.53 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.564 -0.71 . . . . 3.28 111.613 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 1.202 ' OD1' ' CB ' ' A' ' 45' ' ' ASN . 2.4 t30 -143.72 16.59 1.8 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.026 -1.046 . . . . 1.96 111.225 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . 1.273 ' CD ' ' CB ' ' A' ' 46' ' ' GLU . 1.4 tt0 -80.24 -50.88 1.11 Allowed Pre-proline 0 C--N 1.299 -1.606 0 O-C-N 120.867 -1.145 . . . . 2.52 110.893 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.625 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.4 Cg_endo -75.81 168.81 23.52 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 O-C-N 123.127 1.067 . . . . 0.58 110.465 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' THR . . . . . 1.104 ' HG1' ' CB ' ' A' ' 48' ' ' THR . 19.5 m -135.94 -42.21 0.66 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.47 -0.769 . . . . 1.33 110.517 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' GLN . . . . . 1.514 ' NE2' ' CG ' ' A' ' 49' ' ' GLN . 12.6 mm-40 -95.37 -159.05 0.69 Allowed 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.915 -1.116 . . . . 2.43 110.063 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLN . . . . . 1.612 ' HG2' ' CB ' ' A' ' 50' ' ' GLN . 5.4 mp0 -65.74 -12.69 55.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.26 -0.9 . . . . 2.73 110.952 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' GLN . . . . . 1.041 ' OE1' ' CG ' ' A' ' 51' ' ' GLN . 56.5 tt0 -56.36 -20.2 18.11 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.288 -0.882 . . . . 1.77 110.75 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 1.445 ' CD ' ' CZ ' ' A' ' 52' ' ' ARG . 45.5 ttt180 -51.44 -48.9 62.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.174 -0.954 . . . . 2.75 110.752 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ALA . . . . . 0.987 ' HB1' ' CB ' ' A' ' 53' ' ' ALA . . . -77.3 -34.8 55.41 Favored 'General case' 1 C--O 1.147 -4.314 0 O-C-N 120.679 -1.263 . . . . 1.16 110.318 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ALA . . . . . 0.42 ' CB ' ' HD2' ' A' ' 13' ' ' ARG . . . -63.15 -36.75 84.64 Favored 'General case' 1 C--N 1.241 -4.11 0 O-C-N 118.042 -2.911 . . . . 0.99 110.666 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' MET . . . . . 1.734 ' HE3' ' SD ' ' A' ' 55' ' ' MET . 11.8 ttt -78.26 -34.54 48.97 Favored 'General case' 0 C--N 1.293 -1.858 0 O-C-N 121.194 -0.941 . . . . 2.27 110.246 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . 1.469 HD13 ' CG ' ' A' ' 56' ' ' LEU . 13.3 tp -69.16 -41.58 77.06 Favored 'General case' 0 C--N 1.287 -2.152 0 O-C-N 120.616 -1.303 . . . . 1.51 110.441 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . 1.443 HD11 ' CG1' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -65.62 -37.37 79.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 O-C-N 121.1 -1.0 . . . . 1.29 110.174 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 1.582 ' HE3' ' CD ' ' A' ' 58' ' ' LYS . 12.7 mttt -66.8 -39.91 87.93 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.044 -1.035 . . . . 2.03 110.017 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' MET . . . . . 1.531 ' HE2' ' SD ' ' A' ' 59' ' ' MET . 5.6 mmt -58.62 -31.18 67.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.882 . . . . 1.91 110.229 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ILE . . . . . 0.998 HG22 ' CG2' ' A' ' 60' ' ' ILE . 98.6 mt -63.59 -53.96 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.303 -0.873 . . . . 1.1 109.938 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.97 HD12 ' CG ' ' A' ' 61' ' ' LEU . 2.0 mm? -75.24 -32.46 61.12 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.405 -0.809 . . . . 1.12 110.672 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 1.515 ' HE3' ' CD ' ' A' ' 62' ' ' LYS . 16.9 mmtt -61.19 -27.9 68.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.15 -0.969 . . . . 2.24 110.567 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 1.532 ' CG ' ' CE ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -73.43 -65.0 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.233 -0.917 . . . . 3.03 110.363 -179.917 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 1.18 ' OD2' ' CB ' ' A' ' 64' ' ' ASP . 13.4 t0 -159.73 165.34 32.72 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.345 -0.847 . . . . 1.75 110.211 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ASN . . . . . 0.997 ' ND2' ' CB ' ' A' ' 65' ' ' ASN . 2.7 m-20 -80.07 -26.4 39.66 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.287 -0.883 . . . . 1.66 110.32 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASP . . . . . 0.997 ' OD2' ' CB ' ' A' ' 66' ' ' ASP . 12.4 m-20 -61.43 -35.36 77.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.876 . . . . 1.24 110.347 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.4 t -62.59 -34.57 77.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.274 -0.891 . . . . 0.92 110.162 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' TYR . . . . . 1.395 ' CZ ' ' CD2' ' A' ' 68' ' ' TYR . 19.3 t80 -64.33 -38.53 91.37 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.211 -0.931 . . . . 2.18 110.068 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . 0.976 HG13 ' CB ' ' A' ' 69' ' ' VAL . 59.7 t -68.0 -39.32 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.281 -0.887 . . . . 1.11 110.052 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' SER . . . . . 1.136 ' HG ' ' CB ' ' A' ' 70' ' ' SER . 34.6 t -66.78 -36.53 82.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.23 -0.919 . . . . 0.9 110.054 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' PHE . . . . . 1.426 ' CZ ' ' CD1' ' A' ' 71' ' ' PHE . 1.2 t80 -55.43 -37.43 67.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.288 -0.882 . . . . 2.18 109.886 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 1.367 ' CG ' ' CE2' ' A' ' 72' ' ' TYR . 44.8 t80 -64.41 -43.85 93.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 2.14 110.104 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASN . . . . . 1.011 ' ND2' ' CB ' ' A' ' 73' ' ' ASN . 8.9 t30 -75.44 -26.73 58.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.271 -0.893 . . . . 1.64 110.463 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.03 94.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.93 . . . . 1.0 110.338 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' LEU . . . . . 1.015 HD11 ' CG ' ' A' ' 75' ' ' LEU . 16.8 mt -75.26 -38.44 60.47 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.949 -1.095 . . . . 1.13 110.274 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . 0.992 HD22 ' CG ' ' A' ' 76' ' ' LEU . 29.9 mt -67.25 -15.13 63.52 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.405 -0.809 . . . . 1.14 110.554 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' HIS . . . . . 1.532 ' HD2' ' CG ' ' A' ' 77' ' ' HIS . 3.5 t-80 -62.32 -24.7 67.47 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 2.18 110.751 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLU . . . . . 1.447 ' OE1' ' CG ' ' A' ' 78' ' ' GLU . 28.0 mt-10 -109.74 -75.21 0.63 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.172 -0.955 . . . . 1.59 110.414 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.89 47.77 0.15 Allowed Glycine 0 C--O 1.187 -2.791 0 N-CA-C 109.438 -1.465 . . . . 0.55 109.438 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' TYR . . . . . 1.409 ' CG ' ' CE2' ' A' ' 80' ' ' TYR . 34.6 m-85 -106.16 16.22 25.23 Favored 'General case' 0 C--N 1.276 -2.599 0 O-C-N 120.029 -1.865 . . . . 2.3 110.534 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 1.564 ' HZ1' ' CE ' ' A' ' 81' ' ' LYS . 46.6 tttt -44.88 -31.59 1.3 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.424 -0.797 . . . . 2.13 110.953 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . 1.005 ' OD1' ' CB ' ' A' ' 82' ' ' ASP . 2.7 m-20 -68.34 -51.98 38.38 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 1.26 109.9 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 1.627 HD22 ' CG ' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -72.12 -44.12 63.65 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.048 -1.033 . . . . 2.1 110.174 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . 0.985 ' HB2' ' CA ' ' A' ' 84' ' ' ALA . . . -60.02 -35.06 74.25 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.405 -0.81 . . . . 1.21 110.228 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ALA . . . . . 0.982 ' HB3' ' CA ' ' A' ' 85' ' ' ALA . . . -62.43 -36.0 81.02 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.306 -0.871 . . . . 1.12 110.169 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' LEU . . . . . 1.606 HD22 ' CG ' ' A' ' 86' ' ' LEU . 9.1 tp -60.31 -43.54 96.25 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.35 -0.844 . . . . 2.13 110.368 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' LEU . . . . . 1.002 HD23 ' CG ' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -75.29 -35.44 61.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.208 -0.933 . . . . 1.22 110.25 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' HIS . . . . . 1.535 ' HD2' ' CG ' ' A' ' 88' ' ' HIS . 22.7 t-80 -68.97 -39.25 79.57 Favored 'General case' 0 C--O 1.187 -2.226 0 O-C-N 120.93 -1.106 . . . . 2.15 110.559 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ASP . . . . . 0.981 ' OD1' ' CB ' ' A' ' 89' ' ' ASP . 53.4 m-20 -69.67 -18.87 63.6 Favored 'General case' 0 C--N 1.278 -2.542 0 O-C-N 120.165 -1.585 . . . . 1.32 110.908 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.63 -14.78 52.21 Favored Glycine 0 C--O 1.189 -2.681 0 C-N-CA 119.709 -1.234 . . . . 0.68 110.363 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' ILE . . . . . 1.41 HD12 ' CG1' ' A' ' 91' ' ' ILE . 33.9 mt -64.75 -54.33 36.72 Favored Pre-proline 0 C--N 1.286 -2.188 0 O-C-N 120.488 -1.596 . . . . 1.35 110.452 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.7 Cg_endo . . . . . 0 C--O 1.178 -2.525 0 O-C-N 123.158 1.083 . . . . 0.86 110.762 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 tpp . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.155 0.503 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.424 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 38.3 p-10 -106.65 99.53 9.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.413 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.49 -25.5 57.37 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.262 -0.899 . . . . 0.0 110.211 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -59.16 -35.71 74.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 110.516 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -56.06 -40.78 74.08 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.096 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 4.0 ttp180 -62.29 -32.49 73.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.37 -0.831 . . . . 0.0 109.653 179.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 0.406 ' HA ' HD12 ' A' ' 10' ' ' LEU . 96.2 m-20 -77.88 -25.14 48.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.924 179.554 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 t -59.75 -54.19 49.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.935 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.453 ' CD2' ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -62.47 -36.92 84.0 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.406 -0.809 . . . . 0.0 109.614 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 7' ' ' ASN . 12.3 mt -67.93 -35.3 78.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 109.54 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -90.79 2.64 55.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.42 -0.8 . . . . 0.0 110.122 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.404 ' CD2' ' O ' ' A' ' 12' ' ' HIS . 72.3 t60 -92.59 19.04 7.78 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.302 -0.874 . . . . 0.0 110.224 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -69.21 -44.29 72.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 110.138 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.48 -32.61 74.32 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.395 -0.815 . . . . 0.0 110.169 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.28 -42.31 55.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.326 -0.859 . . . . 0.0 110.169 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.455 ' HG ' ' HB ' ' A' ' 20' ' ' ILE . 5.2 tt -75.93 -37.42 58.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.426 -0.796 . . . . 0.0 110.244 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -53.53 -41.44 66.38 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.406 -0.809 . . . . 0.0 110.469 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -85.46 -34.32 21.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.512 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.22 -65.53 1.0 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.256 -0.903 . . . . 0.0 110.782 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.455 ' HB ' ' HG ' ' A' ' 16' ' ' LEU . 11.0 mm -108.44 111.13 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.295 -0.878 . . . . 0.0 110.647 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.565 ' O ' ' C ' ' A' ' 22' ' ' THR . 4.3 mtpt -97.06 141.75 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.598 -0.689 . . . . 0.0 109.349 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 21' ' ' LYS . 69.5 p -24.44 97.4 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 CA-C-O 121.455 0.645 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 27.5 t -157.36 -176.8 6.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.556 -0.715 . . . . 0.0 110.154 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 15.9 t80 -33.54 -41.58 0.09 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.773 -0.58 . . . . 0.0 111.788 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.41 HG13 HD11 ' A' ' 20' ' ' ILE . 44.0 mm -59.38 -50.01 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.053 -1.03 . . . . 0.0 110.007 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -75.65 -37.49 59.62 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.339 -0.851 . . . . 0.0 110.439 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -72.35 -57.56 4.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.255 -0.903 . . . . 0.0 110.605 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -51.7 -25.22 6.87 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.313 -0.867 . . . . 0.0 110.579 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.6 -57.07 3.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.308 -0.87 . . . . 0.0 110.174 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 83.9 mt -57.12 -47.33 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.271 -0.893 . . . . 0.0 109.937 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 75.0 m -66.27 -15.15 62.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.377 -0.827 . . . . 0.0 110.36 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -59.67 -28.91 67.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.284 -0.885 . . . . 0.0 110.395 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.32 -18.11 1.33 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.186 -1.166 . . . . 0.0 110.186 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -54.5 -60.7 2.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.122 -1.222 . . . . 0.0 110.315 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mt -121.66 162.97 19.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.417 -0.802 . . . . 0.0 110.265 -179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.8 p -60.72 147.73 41.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.343 -0.848 . . . . 0.0 110.401 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 88.8 mt -71.37 -17.84 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.398 -0.814 . . . . 0.0 110.242 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 m -58.82 -27.88 65.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.326 -0.859 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -68.43 -26.51 65.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.4 -0.813 . . . . 0.0 110.159 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -63.32 -49.14 75.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.361 -0.837 . . . . 0.0 110.192 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -60.75 -27.97 68.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 110.182 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' O ' ' N ' ' A' ' 46' ' ' GLU . 15.6 tttt -77.92 -58.58 3.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 110.064 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.402 ' O ' ' HD2' ' A' ' 47' ' ' PRO . 65.9 t -50.91 -33.4 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.408 -0.808 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.6 ttp85 -50.8 -42.86 58.55 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.256 -0.903 . . . . 0.0 111.34 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -134.27 8.95 3.73 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.029 -1.044 . . . . 0.0 111.455 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.561 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.0 tp10 -73.96 -53.6 3.96 Favored Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.033 -1.042 . . . . 0.0 110.186 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.561 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -74.41 170.29 20.57 Favored 'Trans proline' 0 C--N 1.313 -1.325 0 O-C-N 123.388 1.204 . . . . 0.0 110.269 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.3 m -135.84 -38.23 0.72 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.391 -0.818 . . . . 0.0 110.436 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -104.25 -157.46 0.61 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.849 . . . . 0.0 110.262 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -58.09 -19.83 35.1 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.344 -0.847 . . . . 0.0 110.55 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 -52.84 -23.82 7.77 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.238 -0.913 . . . . 0.0 110.56 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 21.1 ttp180 -52.98 -53.14 54.31 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.265 -0.897 . . . . 0.0 110.319 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.441 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -80.67 -8.65 59.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.86 . . . . 0.0 110.412 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -83.85 -36.01 23.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.1 -1.0 . . . . 0.0 110.054 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.4 tpp -81.21 -27.4 35.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.353 -0.842 . . . . 0.0 110.162 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -68.87 -38.22 79.57 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.364 -0.835 . . . . 0.0 110.091 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.572 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.1 mp -74.15 -45.76 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.317 -0.864 . . . . 0.0 109.825 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -60.64 -38.44 84.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.256 -0.902 . . . . 0.0 109.675 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.4 mmt -56.55 -36.06 68.84 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.386 -0.821 . . . . 0.0 110.113 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 79.1 mt -58.02 -52.47 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.322 -0.861 . . . . 0.0 109.916 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.424 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.5 mm? -77.37 -29.43 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.412 -0.805 . . . . 0.0 110.706 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -58.58 -25.89 63.04 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.183 -0.948 . . . . 0.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.8 tptm -83.68 -65.57 0.99 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.908 . . . . 0.0 110.271 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -160.54 170.19 21.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.374 -0.829 . . . . 0.0 110.297 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -84.16 -20.11 32.98 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.421 -0.799 . . . . 0.0 110.271 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -60.41 -43.04 97.11 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.25 -0.906 . . . . 0.0 110.294 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.1 t -61.32 -32.48 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.41 -0.806 . . . . 0.0 110.309 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.453 ' CE1' ' CD2' ' A' ' 9' ' ' LEU . 6.4 t80 -64.1 -37.18 86.51 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.384 -0.823 . . . . 0.0 110.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.07 -31.82 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.37 -0.831 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.0 t -69.88 -43.57 71.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.294 -0.879 . . . . 0.0 110.019 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.423 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 1.1 t80 -53.93 -35.69 61.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.334 -0.854 . . . . 0.0 109.612 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.453 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 25.2 t80 -63.74 -38.5 91.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.499 -0.75 . . . . 0.0 109.858 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -82.96 -25.52 32.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.405 -0.809 . . . . 0.0 110.158 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.43 80.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 80' ' ' TYR . 45.1 mt -78.36 -40.08 37.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.42 -0.8 . . . . 0.0 110.151 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.419 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.5 mt -65.68 -15.5 62.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.359 -0.838 . . . . 0.0 110.397 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -65.36 -26.32 67.97 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.224 -0.922 . . . . 0.0 110.58 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -108.01 -75.16 0.64 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.922 . . . . 0.0 110.595 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.0 62.93 0.11 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.425 ' CD2' HD22 ' A' ' 75' ' ' LEU . 26.1 m-85 -124.93 16.25 8.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.435 -1.039 . . . . 0.0 110.478 -179.987 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -46.32 -29.21 1.56 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.376 -0.827 . . . . 0.0 111.031 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.13 -65.05 0.75 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.301 -0.875 . . . . 0.0 110.077 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.5 tt -66.77 -39.8 87.99 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 110.028 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.45 -39.26 60.86 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.278 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.16 90.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.791 . . . . 0.0 109.902 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.6 tt -52.52 -46.4 66.67 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.4 -0.812 . . . . 0.0 110.568 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.3 mp -73.06 -48.5 35.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.358 -0.839 . . . . 0.0 110.288 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.453 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 78.1 t60 -65.37 -16.09 63.25 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.388 -0.82 . . . . 0.0 110.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -85.02 -14.77 46.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.191 -0.943 . . . . 0.0 110.747 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -111.33 -22.86 5.97 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.573 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 54.7 mt -60.59 -52.06 75.39 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.154 -1.204 . . . . 0.0 110.822 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.573 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.6 Cg_endo -72.09 -88.44 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.23 0 O-C-N 123.221 1.116 . . . . 0.0 110.581 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.0 t -105.87 165.84 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.049 -1.032 . . . . 0.0 109.958 179.979 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 54.3 t -84.26 -68.62 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.29 -0.881 . . . . 0.0 110.04 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.1 t -164.91 -52.89 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.388 -0.82 . . . . 0.0 110.091 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.5 p -93.69 -60.57 1.73 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.357 -0.84 . . . . 0.0 110.175 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 42.4 m . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.195 -179.955 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.198 0.523 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.44 ' N ' ' OD1' ' A' ' 2' ' ' ASP . 37.9 p-10 -133.61 99.89 4.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.447 -0.783 . . . . 0.0 110.304 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.56 -31.34 72.51 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.272 -0.892 . . . . 0.0 110.326 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -63.35 -32.43 73.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.263 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.32 95.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.382 -0.824 . . . . 0.0 110.071 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -65.62 -29.66 70.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.367 -0.833 . . . . 0.0 110.126 179.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 28.1 m120 -74.08 -31.73 62.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.4 -0.813 . . . . 0.0 110.142 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 47.1 t -60.63 -51.9 67.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.4 -0.812 . . . . 0.0 110.294 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.406 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 0.6 OUTLIER -61.98 -35.26 77.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.368 -0.832 . . . . 0.0 110.057 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 67.4 mt -63.14 -34.36 77.44 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.278 -0.889 . . . . 0.0 109.89 179.706 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -97.02 24.98 5.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.391 -0.818 . . . . 0.0 110.066 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.411 ' CD2' ' HB2' ' A' ' 16' ' ' LEU . 63.6 t60 -94.81 20.02 9.33 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.336 -0.853 . . . . 0.0 110.451 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 70.4 ttp85 -69.29 -56.94 6.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.308 -0.87 . . . . 0.0 110.114 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -65.14 -35.27 80.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.289 -0.882 . . . . 0.0 110.101 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.0 -46.24 65.55 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.371 -0.831 . . . . 0.0 110.298 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.411 ' HB2' ' CD2' ' A' ' 12' ' ' HIS . 1.2 tp -59.35 -39.95 84.85 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.38 -41.64 66.09 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.403 -0.811 . . . . 0.0 110.265 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -85.06 -23.22 28.65 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.391 -0.818 . . . . 0.0 110.152 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.99 -65.25 1.03 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.256 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.431 HG22 HD12 ' A' ' 20' ' ' ILE . 14.8 mt -147.24 158.38 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.335 -0.853 . . . . 0.0 110.52 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.577 ' O ' ' C ' ' A' ' 22' ' ' THR . 5.6 mttt -114.34 141.91 47.0 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 21' ' ' LYS . 58.9 p -24.23 98.75 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 CA-C-O 121.516 0.674 . . . . 0.0 110.999 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.8 t -152.06 -176.22 5.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.568 -0.707 . . . . 0.0 110.308 -178.658 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.9 t80 -32.87 -38.94 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.866 -0.521 . . . . 0.0 112.224 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 43.9 mm -55.89 -66.31 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 120.954 -1.091 . . . . 0.0 110.175 -179.73 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.4 ' CE ' ' CD1' ' A' ' 57' ' ' ILE . 13.9 mmm -76.53 -35.93 58.0 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.36 -0.837 . . . . 0.0 110.259 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -60.14 -52.68 64.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.432 -0.792 . . . . 0.0 110.458 -179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -58.49 -29.7 66.44 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.304 -0.872 . . . . 0.0 110.248 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.5 mtt -69.8 -42.5 73.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.271 -0.893 . . . . 0.0 110.294 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 59.2 mt -55.16 -50.24 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.258 -0.901 . . . . 0.0 110.196 179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.1 m -74.34 -14.97 60.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.409 -0.807 . . . . 0.0 110.301 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.28 -31.2 65.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.268 -0.895 . . . . 0.0 110.45 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 147.47 -20.03 1.51 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.972 -1.251 . . . . 0.0 109.972 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.409 ' CE1' ' HA ' ' A' ' 67' ' ' SER . 20.7 m-85 -57.15 -51.65 68.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.163 -1.198 . . . . 0.0 110.203 -179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mp -132.12 155.48 48.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.367 -0.833 . . . . 0.0 110.115 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.4 p -57.48 160.22 4.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.414 -0.804 . . . . 0.0 110.324 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 0.419 HG23 HD11 ' A' ' 37' ' ' ILE . 84.2 mt -71.19 -15.31 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.372 -0.83 . . . . 0.0 110.322 179.999 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.3 m -56.18 -26.17 49.64 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.276 -0.89 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -66.55 -34.03 77.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.321 -0.862 . . . . 0.0 110.219 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -68.46 -37.11 79.9 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.315 -0.865 . . . . 0.0 110.174 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.21 -33.82 76.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.428 -0.795 . . . . 0.0 110.1 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -75.99 -60.56 2.27 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.354 -0.841 . . . . 0.0 110.1 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 80.4 t -48.53 -33.6 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.491 -0.755 . . . . 0.0 110.546 179.866 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -43.8 -48.71 8.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.643 -0.661 . . . . 0.0 111.403 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -145.26 14.36 1.45 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.118 -0.989 . . . . 0.0 111.235 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.615 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.1 tp10 -80.17 -47.84 1.33 Allowed Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.032 -1.042 . . . . 0.0 110.962 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.615 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -75.99 170.25 20.49 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.154 1.081 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.7 m -145.86 -45.41 0.21 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.362 -0.836 . . . . 0.0 110.289 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -91.51 -166.87 1.66 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.378 -0.826 . . . . 0.0 110.305 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -17.78 45.29 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.359 -0.838 . . . . 0.0 110.498 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -57.04 -18.89 15.88 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.253 -0.905 . . . . 0.0 110.556 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -49.53 -60.86 2.47 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.353 -0.842 . . . . 0.0 110.579 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.437 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -74.14 -52.57 12.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.152 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.97 -34.21 5.35 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.385 -0.822 . . . . 0.0 110.622 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.6 ttp -82.95 -25.56 32.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 6.6 tt -81.45 -35.69 30.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.345 -0.847 . . . . 0.0 110.342 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.441 HD13 HG23 ' A' ' 57' ' ' ILE . 41.7 mm -64.21 -43.15 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.244 -0.91 . . . . 0.0 109.934 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -61.06 -41.1 95.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.345 -0.847 . . . . 0.0 109.915 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.1 mtp -56.23 -33.33 65.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.303 -0.873 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.6 mt -61.19 -53.72 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.241 -0.912 . . . . 0.0 109.985 179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.406 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.0 mm? -76.76 -30.22 56.45 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.473 -0.767 . . . . 0.0 110.506 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -26.62 66.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.302 -0.874 . . . . 0.0 110.221 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -64.99 1.03 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.356 -0.84 . . . . 0.0 110.166 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -159.93 155.74 26.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.401 -0.812 . . . . 0.0 110.219 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -77.23 -23.9 51.3 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.357 -0.84 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.08 -29.65 68.72 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.377 -0.827 . . . . 0.0 110.283 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.409 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 12.2 t -68.93 -34.91 76.14 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.304 -0.873 . . . . 0.0 110.053 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 19.9 t80 -62.45 -34.6 77.13 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.452 -0.78 . . . . 0.0 110.01 179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.89 -40.85 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.41 -0.807 . . . . 0.0 110.033 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -69.42 -34.69 74.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.306 -0.871 . . . . 0.0 110.086 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.461 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 32.6 t80 -53.14 -35.48 59.78 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.054 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.404 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 47.6 t80 -70.68 -44.6 66.69 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.333 -0.854 . . . . 0.0 110.198 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -73.26 -27.88 61.82 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.37 -0.831 . . . . 0.0 110.479 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -48.9 65.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.294 -0.879 . . . . 0.0 110.384 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.461 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 14.9 mt -66.46 -44.61 82.31 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.333 -0.855 . . . . 0.0 110.351 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 35.1 mt -65.32 -15.03 62.11 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 110.544 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -63.33 -24.46 67.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.204 -0.935 . . . . 0.0 110.632 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -112.03 -75.24 0.61 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.206 -0.933 . . . . 0.0 110.543 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -170.8 66.19 0.15 Allowed Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 20.0 m-85 -125.09 16.37 8.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -1.039 . . . . 0.0 110.481 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -43.14 -31.3 0.56 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.914 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.6 -42.08 59.31 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.387 -0.82 . . . . 0.0 109.779 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.402 ' CD1' ' C ' ' A' ' 83' ' ' LEU . 3.4 tm? -73.24 -44.57 59.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.48 -0.763 . . . . 0.0 109.848 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.404 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.34 -33.55 73.81 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.391 -0.818 . . . . 0.0 110.043 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.42 -36.44 82.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 110.113 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.12 -56.96 15.26 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.421 -0.8 . . . . 0.0 110.23 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.24 -35.69 76.39 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.906 . . . . 0.0 110.072 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.404 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 49.1 t60 -62.15 -37.57 85.71 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -65.96 -17.56 64.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.426 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -102.57 -2.11 50.1 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.508 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 18.5 mt -72.04 -55.48 5.14 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.278 . . . . 0.0 110.34 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.508 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.1 Cg_endo -71.29 -89.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 O-C-N 123.265 1.139 . . . . 0.0 110.54 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 87.8 t -150.16 146.26 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.031 -1.043 . . . . 0.0 109.959 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.1 t -70.68 -32.35 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.348 -0.845 . . . . 0.0 110.027 179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 32.2 t -70.24 -27.15 64.23 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 110.294 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 4.0 m -68.73 -65.64 0.68 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.311 -0.868 . . . . 0.0 110.169 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.207 -179.933 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 mtp . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.162 0.506 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -80.99 149.12 29.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.398 -0.814 . . . . 0.0 110.3 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -73.08 -24.8 60.71 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.388 -0.82 . . . . 0.0 110.312 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -56.19 -39.5 72.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.32 -0.863 . . . . 0.0 110.458 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.09 -36.98 83.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.287 -0.883 . . . . 0.0 110.188 -179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.6 ttp180 -72.01 -44.09 63.99 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.89 -25.21 67.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.296 -0.877 . . . . 0.0 110.238 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.75 -57.59 10.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.338 -0.851 . . . . 0.0 110.141 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.408 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -56.4 -34.75 67.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.315 -0.866 . . . . 0.0 110.131 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 90.9 mt -80.6 -20.34 43.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.35 -0.844 . . . . 0.0 110.429 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -110.53 31.49 5.92 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -0.856 . . . . 0.0 110.381 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.5 t-160 -142.41 45.0 1.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.351 -0.843 . . . . 0.0 109.987 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -75.09 -37.31 61.59 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.442 -0.786 . . . . 0.0 110.507 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.43 -35.47 65.44 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.175 -0.953 . . . . 0.0 110.595 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.433 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -85.59 -56.3 3.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.288 -0.882 . . . . 0.0 110.312 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 56.7 tp -55.85 -42.64 76.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.343 -0.848 . . . . 0.0 110.59 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -60.51 -49.29 78.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 0.0 110.079 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -72.19 -26.35 62.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.364 -0.835 . . . . 0.0 110.04 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -72.41 -58.65 3.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.85 . . . . 0.0 110.09 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.416 HD13 HG13 ' A' ' 25' ' ' ILE . 22.8 mt -135.59 109.86 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.366 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.567 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.8 mttt -79.45 142.67 35.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.556 -0.715 . . . . 0.0 109.558 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.567 ' C ' ' O ' ' A' ' 21' ' ' LYS . 61.6 p -23.75 97.34 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 CA-C-O 121.454 0.645 . . . . 0.0 111.09 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 24' ' ' TYR . 32.7 t -152.87 -176.52 5.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.712 -0.617 . . . . 0.0 110.222 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.446 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.7 t80 -33.0 -44.5 0.11 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.826 -0.546 . . . . 0.0 111.957 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.416 HG13 HD13 ' A' ' 20' ' ' ILE . 43.0 mm -54.74 -63.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.075 -1.016 . . . . 0.0 110.195 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 15.1 mtt -75.37 -39.03 59.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -59.79 -51.47 69.59 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.367 -0.833 . . . . 0.0 110.565 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -54.47 -36.1 63.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.268 -0.895 . . . . 0.0 110.337 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -32.19 73.5 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -0.825 . . . . 0.0 110.079 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 47.2 mm -60.78 -65.13 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.295 -0.878 . . . . 0.0 110.062 179.897 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -68.67 -18.62 64.31 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.395 -0.816 . . . . 0.0 110.551 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -24.44 25.89 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.184 -0.947 . . . . 0.0 110.374 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 -13.94 4.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.413 ' CE1' ' HA ' ' A' ' 67' ' ' SER . 25.0 m-85 -69.62 -55.24 10.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -1.187 . . . . 0.0 110.454 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.6 mp -121.83 165.17 16.29 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.326 -0.859 . . . . 0.0 110.416 -179.761 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.0 p -65.16 147.68 53.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 110.24 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.1 mt -73.14 -20.85 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.412 -0.805 . . . . 0.0 110.219 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 m -57.91 -36.79 72.95 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.228 -0.92 . . . . 0.0 110.356 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.2 tt0 -63.61 -26.84 68.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.368 -0.833 . . . . 0.0 110.212 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -68.69 -45.31 72.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.327 -0.858 . . . . 0.0 110.136 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -63.13 -36.42 83.55 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.316 -0.865 . . . . 0.0 110.152 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -58.24 3.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.423 -0.798 . . . . 0.0 110.179 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 68.9 t -50.83 -33.55 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.384 -0.823 . . . . 0.0 110.346 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -46.06 -32.4 2.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.509 -0.744 . . . . 0.0 111.468 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -145.42 21.7 1.51 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.01 -1.057 . . . . 0.0 111.309 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.433 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 0.3 OUTLIER -85.87 -54.53 0.41 Allowed Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.091 -1.006 . . . . 0.0 110.767 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.433 ' HD3' ' CB ' ' A' ' 46' ' ' GLU . 49.9 Cg_endo -77.22 163.87 29.84 Favored 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.456 1.24 . . . . 0.0 110.614 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.9 m -137.4 -42.96 0.55 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.348 -0.845 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.26 -161.25 0.57 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.056 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -15.07 56.17 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.299 -0.875 . . . . 0.0 110.636 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -55.98 -20.16 15.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.193 -0.942 . . . . 0.0 110.664 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 25.7 ttm180 -51.45 -54.82 23.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.168 -0.958 . . . . 0.0 110.606 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.36 -29.2 34.15 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.331 -0.856 . . . . 0.0 110.188 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -62.45 -32.16 72.99 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.257 179.912 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 4.9 ttt -80.63 -48.16 13.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.427 -0.795 . . . . 0.0 110.31 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 23.4 tp -58.68 -36.36 74.07 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.379 -179.926 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.479 HD11 ' N ' ' A' ' 57' ' ' ILE . 0.2 OUTLIER -61.6 -44.47 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.434 -0.791 . . . . 0.0 109.672 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -70.28 -36.77 74.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.47 -0.769 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 21.4 mmt -59.52 -36.53 76.3 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.339 -0.851 . . . . 0.0 110.367 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 77.0 mt -60.67 -58.56 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.452 -0.78 . . . . 0.0 110.239 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.408 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 1.7 mm? -69.43 -40.28 77.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.572 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -59.08 -31.17 68.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.302 -0.874 . . . . 0.0 110.411 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -65.09 0.73 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.319 -0.863 . . . . 0.0 110.183 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -160.16 158.62 30.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.288 -0.882 . . . . 0.0 110.213 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -81.84 -26.86 33.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.456 -0.777 . . . . 0.0 110.194 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.52 -34.25 77.38 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.294 -0.879 . . . . 0.0 110.261 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.413 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 33.3 t -65.15 -36.89 85.65 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.353 -0.842 . . . . 0.0 110.155 -179.982 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.9 t80 -59.25 -36.62 75.82 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.39 -0.819 . . . . 0.0 110.105 179.963 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.75 -46.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.361 -0.837 . . . . 0.0 109.986 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.5 t -62.02 -33.97 75.34 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.304 -0.873 . . . . 0.0 109.999 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.473 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 3.3 t80 -57.74 -36.67 72.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.35 -0.844 . . . . 0.0 109.787 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.426 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 34.6 t80 -62.74 -41.86 99.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.496 -0.752 . . . . 0.0 109.941 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.81 -27.35 40.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.4 -0.813 . . . . 0.0 110.225 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.37 -47.79 84.56 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.325 -0.86 . . . . 0.0 110.192 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.473 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 7.8 mt -66.78 -41.17 88.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.328 -0.857 . . . . 0.0 110.224 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 43.6 mt -66.68 -15.11 63.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.421 -0.799 . . . . 0.0 110.57 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -61.96 -22.41 65.62 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.191 -0.943 . . . . 0.0 110.549 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -112.53 -75.15 0.61 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.22 -0.925 . . . . 0.0 110.426 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.97 36.9 0.11 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.413 ' CE2' HD12 ' A' ' 20' ' ' ILE . 18.9 m-85 -93.78 16.44 14.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.458 -1.025 . . . . 0.0 110.49 -179.93 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -42.19 -31.33 0.37 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.522 -0.736 . . . . 0.0 110.906 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -67.52 -48.1 68.01 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.356 -0.84 . . . . 0.0 109.703 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -78.09 -44.02 27.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.508 -0.745 . . . . 0.0 109.827 179.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.15 -43.47 92.06 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.349 -0.844 . . . . 0.0 110.238 179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.03 -29.72 70.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.35 -0.844 . . . . 0.0 110.11 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.7 tp -57.43 -46.09 83.93 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.355 -0.841 . . . . 0.0 110.309 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mp -73.97 -33.42 63.86 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.426 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 13.3 t-160 -58.91 -25.77 63.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.348 -0.845 . . . . 0.0 110.386 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -85.04 -18.85 33.09 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.335 -0.853 . . . . 0.0 110.451 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -97.08 -26.98 9.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.555 ' N ' ' HD2' ' A' ' 92' ' ' PRO . 42.9 mt -56.87 -47.88 98.3 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.352 -1.087 . . . . 0.0 110.977 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.555 ' HD2' ' N ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo -70.44 -89.76 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.225 0 O-C-N 123.223 1.117 . . . . 0.0 110.72 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 60.7 t -147.82 145.42 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 120.897 -1.127 . . . . 0.0 110.268 -179.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.4 t -122.33 -26.93 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.413 -0.804 . . . . 0.0 110.375 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 31.4 t -56.75 -73.5 0.06 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.229 -0.92 . . . . 0.0 110.547 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.6 t -100.48 -71.05 0.72 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.324 -0.86 . . . . 0.0 110.338 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.215 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 ttt . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.247 0.546 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -92.77 129.11 38.8 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.369 -0.832 . . . . 0.0 110.292 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.74 -24.69 67.82 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.409 -0.807 . . . . 0.0 110.263 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -29.35 61.14 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.329 -0.857 . . . . 0.0 110.575 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.69 -38.04 88.84 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.235 -0.915 . . . . 0.0 110.223 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -68.1 -28.51 67.4 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.206 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -79.44 -27.21 41.68 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.351 -0.843 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.62 -51.0 70.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.474 -0.766 . . . . 0.0 110.165 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.415 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 3.0 tm? -62.53 -36.77 83.64 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.369 -0.832 . . . . 0.0 109.752 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.47 -27.53 62.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.319 -0.863 . . . . 0.0 110.137 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -98.07 27.47 4.55 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.285 -0.884 . . . . 0.0 110.121 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.43 ' CE1' HD23 ' A' ' 86' ' ' LEU . 3.5 t-160 -124.22 26.92 7.27 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.468 -0.77 . . . . 0.0 109.9 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -75.68 -36.58 60.03 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.286 -0.884 . . . . 0.0 110.475 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -68.36 -36.0 78.55 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.295 -0.878 . . . . 0.0 110.617 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.419 ' CB ' ' CD2' ' A' ' 12' ' ' HIS . . . -85.05 -30.28 24.24 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.361 -0.837 . . . . 0.0 110.027 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.405 ' CD2' ' CG1' ' A' ' 57' ' ' ILE . 1.3 tp -80.72 -44.03 19.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.395 -0.815 . . . . 0.0 110.032 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -59.16 -35.66 73.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.385 -0.822 . . . . 0.0 110.071 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -78.2 -41.78 33.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.38 -0.825 . . . . 0.0 110.285 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.24 -65.28 1.03 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.241 -0.912 . . . . 0.0 110.514 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 12.8 mm -94.95 109.69 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.544 ' O ' ' C ' ' A' ' 22' ' ' THR . 2.7 mtpm? -103.28 141.3 36.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.59 -0.694 . . . . 0.0 109.284 179.15 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.544 ' C ' ' O ' ' A' ' 21' ' ' LYS . 73.4 p -24.68 98.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.677 -0.64 . . . . 0.0 110.987 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.438 ' O ' ' C ' ' A' ' 24' ' ' TYR . 81.4 p -159.97 -176.58 5.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.559 -0.713 . . . . 0.0 110.377 -178.628 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.438 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.7 t80 -33.55 -39.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.86 -0.525 . . . . 0.0 111.939 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 44.8 mm -57.23 -65.69 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.029 -1.044 . . . . 0.0 109.997 -179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -76.11 -40.87 51.94 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 110.189 179.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -55.02 -60.02 3.95 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.363 -0.835 . . . . 0.0 110.717 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -56.73 -38.82 72.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.35 -0.844 . . . . 0.0 110.457 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.5 ttp -62.99 -28.11 69.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.377 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 27.2 mt -83.85 -34.55 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.259 -0.9 . . . . 0.0 110.29 -179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -87.26 -18.73 29.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.294 -0.879 . . . . 0.0 110.512 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -57.58 -23.7 52.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.238 -0.914 . . . . 0.0 110.38 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 141.23 -17.13 2.72 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.821 -1.311 . . . . 0.0 109.821 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 7.1 m-30 -53.84 -66.6 0.36 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.237 -1.154 . . . . 0.0 110.333 -179.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.513 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 4.0 mm? -106.44 165.15 11.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.488 -0.757 . . . . 0.0 110.058 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.3 p -59.59 169.34 1.34 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.432 -0.792 . . . . 0.0 110.273 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.8 mt -84.68 -24.45 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.384 -0.823 . . . . 0.0 110.158 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.4 m -58.91 -24.53 62.47 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.348 -0.845 . . . . 0.0 110.365 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -60.67 -35.88 77.35 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.31 -0.869 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.45 -36.34 80.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.75 -27.04 63.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.341 -0.849 . . . . 0.0 110.096 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 ttmt -82.95 -61.75 1.78 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.378 -0.826 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 61.7 t -48.05 -33.75 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.585 -0.697 . . . . 0.0 110.838 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttm-85 -45.98 -47.22 16.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.486 -0.759 . . . . 0.0 111.279 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -144.99 23.82 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.147 -0.971 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.591 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 1.1 tm-20 -81.82 -48.91 0.95 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.863 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.591 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.2 Cg_endo -75.99 169.88 21.23 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.127 1.067 . . . . 0.0 110.526 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.4 m -136.69 -41.97 0.61 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.404 -0.81 . . . . 0.0 110.139 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -100.2 -152.88 0.43 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.009 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.21 -7.65 48.23 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.222 -0.924 . . . . 0.0 110.66 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -55.72 -21.28 17.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.108 -0.995 . . . . 0.0 110.663 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 20.3 ttm180 -52.76 -32.46 43.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.25 -0.906 . . . . 0.0 110.557 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.426 ' O ' HD11 ' A' ' 57' ' ' ILE . . . -91.57 -11.67 36.6 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.299 -0.876 . . . . 0.0 110.524 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.65 -42.76 14.02 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.077 -1.014 . . . . 0.0 110.244 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -43.02 24.17 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.312 -0.867 . . . . 0.0 110.219 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 18.2 tp -60.15 -38.73 84.02 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.245 -0.91 . . . . 0.0 110.125 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.573 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.2 mp -76.51 -34.33 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.368 -0.833 . . . . 0.0 109.684 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -68.06 -38.11 82.06 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.323 -0.861 . . . . 0.0 109.641 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 mtt -59.88 -35.02 73.95 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.029 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.8 mt -58.27 -52.33 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.396 -0.815 . . . . 0.0 110.036 179.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.415 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -75.18 -22.19 58.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.39 -0.819 . . . . 0.0 110.763 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.51 -27.36 63.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.252 -0.905 . . . . 0.0 110.585 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 47.5 tptt -70.8 -65.17 0.77 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.263 -0.898 . . . . 0.0 110.208 -179.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -160.11 155.51 25.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.404 -0.81 . . . . 0.0 110.275 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.8 -28.19 65.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.464 -0.773 . . . . 0.0 110.125 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -62.41 -37.1 84.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.465 -0.772 . . . . 0.0 110.213 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.1 t -60.93 -33.22 72.82 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.294 -0.879 . . . . 0.0 110.174 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -64.86 -39.93 94.34 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.464 -0.772 . . . . 0.0 110.118 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.45 -31.79 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.335 -0.853 . . . . 0.0 110.074 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.6 t -70.61 -38.93 74.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.353 -0.842 . . . . 0.0 109.984 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.483 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 5.0 t80 -54.82 -38.19 67.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.385 -0.822 . . . . 0.0 109.818 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.452 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 28.0 t80 -65.08 -46.87 79.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.377 -0.827 . . . . 0.0 109.941 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -72.02 -25.95 62.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.369 -0.832 . . . . 0.0 110.42 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.32 -45.03 74.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 110.178 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.483 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 28.5 mt -68.56 -38.17 80.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.325 -0.859 . . . . 0.0 110.353 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.445 HD11 ' CD1' ' A' ' 72' ' ' TYR . 22.6 mt -66.38 -15.17 63.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.349 -0.844 . . . . 0.0 110.576 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -63.04 -22.81 67.11 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.214 -0.929 . . . . 0.0 110.549 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.49 -75.46 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.212 -0.93 . . . . 0.0 110.407 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.2 35.94 0.1 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.434 ' CD2' HD22 ' A' ' 75' ' ' LEU . 31.4 m-85 -95.28 16.2 17.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.995 . . . . 0.0 110.449 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.407 ' HA ' ' CD2' ' A' ' 76' ' ' LEU . 11.9 ttpt -46.48 -30.58 2.26 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.392 -0.817 . . . . 0.0 110.973 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -62.09 -60.92 2.9 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.285 -0.884 . . . . 0.0 109.821 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 tt -71.28 -43.8 66.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.442 -0.786 . . . . 0.0 109.992 179.67 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.27 -40.53 71.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.444 -0.785 . . . . 0.0 110.305 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.57 -35.17 75.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.43 HD23 ' CE1' ' A' ' 12' ' ' HIS . 19.3 tp -61.69 -28.24 69.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.369 -0.832 . . . . 0.0 110.271 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -84.62 -39.52 18.58 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.31 -0.869 . . . . 0.0 110.429 -179.935 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.452 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 48.5 t-80 -67.36 -47.8 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -69.59 -15.07 63.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.349 -0.844 . . . . 0.0 110.562 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -91.37 -16.38 53.23 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.528 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 18.7 mt -66.54 -53.77 27.56 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.159 -1.201 . . . . 0.0 110.436 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.528 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo -71.84 -83.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 123.336 1.177 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 59.8 t -127.29 164.49 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.093 -1.005 . . . . 0.0 110.161 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 57.6 t -91.82 -62.9 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.445 -0.784 . . . . 0.0 110.17 179.994 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.7 t -164.83 -55.74 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.312 -0.868 . . . . 0.0 110.266 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.4 m -114.44 -65.08 1.23 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.287 -0.883 . . . . 0.0 110.23 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.2 m . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.236 -179.97 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.161 0.505 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -143.91 142.59 30.86 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.355 -0.841 . . . . 0.0 110.248 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.38 -25.46 68.03 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.451 -0.78 . . . . 0.0 110.272 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -58.17 -50.46 73.46 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.317 -0.865 . . . . 0.0 110.269 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -61.21 -35.65 77.77 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.286 -0.884 . . . . 0.0 109.786 179.676 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 23.0 ttm-85 -68.42 -36.01 78.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.393 -0.817 . . . . 0.0 109.79 179.623 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -65.5 -32.86 74.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.473 -0.767 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.4 t -57.57 -59.83 4.58 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.312 -0.868 . . . . 0.0 110.082 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.449 ' CD2' ' CE1' ' A' ' 68' ' ' TYR . 1.4 tm? -59.33 -34.85 72.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.349 -0.844 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.5 mt -73.62 -28.0 61.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.367 -0.833 . . . . 0.0 110.054 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -93.66 1.98 56.45 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.42 -0.8 . . . . 0.0 110.567 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 4.3 t60 -98.15 28.99 3.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.155 -0.966 . . . . 0.0 109.696 179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -71.01 -55.25 8.68 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.304 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.41 -34.58 75.6 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.2 -34.72 63.81 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.293 -0.879 . . . . 0.0 110.133 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 8.3 tt -77.16 -40.81 44.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.464 -0.773 . . . . 0.0 110.39 -179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.8 -41.88 62.04 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.28 -0.888 . . . . 0.0 110.405 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.6 ttpt -85.5 -32.0 22.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.343 -0.848 . . . . 0.0 110.548 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.419 ' HB3' ' CD1' ' A' ' 83' ' ' LEU . 70.6 m-20 -85.18 -65.53 1.0 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.879 . . . . 0.0 111.01 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 13.4 mm -114.58 122.33 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.23 -0.919 . . . . 0.0 110.569 -179.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.553 ' O ' ' C ' ' A' ' 22' ' ' THR . 19.2 mtmm -113.75 141.89 46.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.631 -0.668 . . . . 0.0 109.23 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.553 ' C ' ' O ' ' A' ' 21' ' ' LYS . 74.0 p -24.1 97.53 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.652 -0.655 . . . . 0.0 111.149 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 24' ' ' TYR . 34.9 t -160.63 -176.75 5.74 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.487 -0.758 . . . . 0.0 110.557 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 23' ' ' SER . 8.1 t80 -33.57 -46.67 0.2 Allowed 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.899 -0.501 . . . . 0.0 112.168 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 38.6 mm -49.91 -64.67 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.06 -1.025 . . . . 0.0 110.527 -179.567 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.437 ' O ' HG12 ' A' ' 30' ' ' ILE . 4.5 mmt -72.75 -53.5 11.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.345 -0.847 . . . . 0.0 110.367 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -46.64 -43.92 17.93 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.51 -0.744 . . . . 0.0 111.067 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 58.0 t60 -59.64 -37.35 78.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.119 -0.988 . . . . 0.0 109.846 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 29.9 mmt -80.26 -28.23 38.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.419 -0.801 . . . . 0.0 110.199 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.437 HG12 ' O ' ' A' ' 26' ' ' MET . 29.4 mm -64.41 -50.45 76.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.351 -0.843 . . . . 0.0 109.937 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.0 m -75.71 -19.74 58.87 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.348 -0.845 . . . . 0.0 110.483 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -24.07 47.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.164 -0.96 . . . . 0.0 110.358 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.47 -17.52 2.06 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.413 ' N ' ' CD1' ' A' ' 34' ' ' PHE . 12.6 m-30 -56.23 -72.33 0.08 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.217 -1.166 . . . . 0.0 110.451 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.519 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 4.0 mm? -106.47 161.82 14.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.293 -0.879 . . . . 0.0 110.227 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 p -70.67 162.5 28.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.403 -0.811 . . . . 0.0 110.095 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.0 mt -79.25 -29.13 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.287 -0.883 . . . . 0.0 110.06 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -61.97 -33.16 73.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.405 -0.809 . . . . 0.0 110.171 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -75.02 -26.74 59.71 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 110.316 179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -74.0 -39.02 63.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.288 -0.882 . . . . 0.0 110.313 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -62.13 -35.93 80.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.296 -0.878 . . . . 0.0 110.261 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' O ' ' N ' ' A' ' 46' ' ' GLU . 16.0 tttt -72.29 -41.89 66.14 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.201 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 98.9 t -58.26 -34.47 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.344 -0.848 . . . . 0.0 110.38 -179.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -55.87 -24.78 38.98 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.333 -0.854 . . . . 0.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -142.69 15.4 1.96 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.128 -0.982 . . . . 0.0 111.073 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.61 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 34.1 tt0 -81.85 -51.19 0.83 Allowed Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.017 -1.052 . . . . 0.0 110.585 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.61 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -76.61 170.2 20.37 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.201 1.106 . . . . 0.0 110.404 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.3 m -124.71 -39.04 2.32 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.36 -0.837 . . . . 0.0 110.274 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -104.31 -153.48 0.48 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.307 -0.871 . . . . 0.0 110.053 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -8.73 51.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.211 -0.931 . . . . 0.0 110.656 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -52.06 -24.97 7.56 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.114 -0.991 . . . . 0.0 110.65 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 24.2 ttp180 -52.95 -25.26 11.37 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.246 -0.909 . . . . 0.0 110.544 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.409 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -86.96 -26.32 23.89 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.309 -0.87 . . . . 0.0 110.315 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.82 -29.41 50.64 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 110.373 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.3 ttt -79.16 -52.47 8.13 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.304 -0.872 . . . . 0.0 110.481 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.1 tp -51.08 -35.06 33.03 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.375 -0.828 . . . . 0.0 110.95 -179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.567 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 0.8 OUTLIER -72.78 -32.19 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.219 -0.926 . . . . 0.0 110.265 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -70.87 -35.63 72.47 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 110.348 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.467 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -65.04 -29.49 70.39 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.229 -0.919 . . . . 0.0 110.141 179.672 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.6 mt -62.74 -53.55 45.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.886 . . . . 0.0 109.684 179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -73.67 -37.22 65.34 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt -60.34 -27.55 67.45 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.336 -0.853 . . . . 0.0 110.524 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -78.67 -64.66 1.12 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.154 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -160.2 153.89 22.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.351 -0.843 . . . . 0.0 110.207 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -74.96 -24.13 58.41 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.32 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -36.82 83.0 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.313 -0.867 . . . . 0.0 110.114 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.8 t -61.66 -31.47 71.59 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.468 -0.77 . . . . 0.0 110.061 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.449 ' CE1' ' CD2' ' A' ' 9' ' ' LEU . 8.7 t80 -68.2 -38.53 82.06 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.323 -0.861 . . . . 0.0 110.008 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.7 -42.54 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.345 -0.847 . . . . 0.0 110.105 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.8 t -62.96 -39.13 93.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.88 . . . . 0.0 109.938 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.442 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 1.8 t80 -53.25 -36.62 61.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.469 -0.77 . . . . 0.0 109.824 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.435 ' CD1' HD12 ' A' ' 76' ' ' LEU . 31.3 t80 -63.53 -45.91 88.39 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.308 -0.87 . . . . 0.0 110.075 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -75.98 -23.07 55.28 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.308 -0.87 . . . . 0.0 110.583 -179.798 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.11 -33.99 75.53 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.176 -0.952 . . . . 0.0 110.403 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.442 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 4.3 mt -84.79 -33.69 22.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.34 -0.85 . . . . 0.0 110.432 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.435 HD12 ' CD1' ' A' ' 72' ' ' TYR . 26.6 mt -67.65 -14.93 63.37 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.375 -0.828 . . . . 0.0 110.584 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -66.51 -24.45 66.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.158 -0.964 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -103.26 -75.1 0.62 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.219 -0.926 . . . . 0.0 110.504 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.85 48.3 0.15 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -106.27 16.16 25.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.435 -1.038 . . . . 0.0 110.495 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -46.14 -32.74 3.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.387 -0.82 . . . . 0.0 110.735 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -68.63 -63.59 1.03 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 109.856 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.419 ' CD1' ' HB3' ' A' ' 19' ' ' ASP . 4.7 tt -62.79 -36.43 83.11 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.89 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.422 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -59.95 -36.69 77.62 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.469 -0.769 . . . . 0.0 110.044 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.23 -34.27 74.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.455 -0.778 . . . . 0.0 110.07 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.423 ' CD1' ' C ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.89 -47.48 84.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.451 -0.781 . . . . 0.0 109.926 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -72.1 -39.96 68.53 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.36 -0.838 . . . . 0.0 110.174 -179.948 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.419 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 27.5 t-80 -62.42 -55.54 26.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.38 -0.825 . . . . 0.0 110.173 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.5 -24.78 61.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.806 . . . . 0.0 110.302 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -75.04 -14.44 81.81 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.543 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 7.9 mt -72.84 -57.64 3.02 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.211 -1.17 . . . . 0.0 110.328 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.543 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 47.1 Cg_endo -72.73 -30.97 11.06 Favored 'Trans proline' 0 C--N 1.314 -1.274 0 O-C-N 123.29 1.153 . . . . 0.0 110.467 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.61 141.41 27.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.329 -0.857 . . . . 0.0 110.104 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.9 t -71.67 -78.41 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.47 -0.769 . . . . 0.0 110.246 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.8 t -137.41 5.33 2.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.257 -0.902 . . . . 0.0 110.822 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 40.4 t -58.03 -28.47 64.5 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.063 -1.023 . . . . 0.0 110.419 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.119 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.253 0.549 . . . . 0.0 110.141 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 2' ' ' ASP . 39.0 p-10 -86.75 100.03 12.2 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.339 -0.851 . . . . 0.0 110.364 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.14 -45.85 38.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.255 -0.903 . . . . 0.0 110.227 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -59.44 -37.44 78.12 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.399 -0.813 . . . . 0.0 110.212 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.21 -38.21 79.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.276 -0.89 . . . . 0.0 109.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 47.2 ttt180 -64.64 -31.93 73.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.381 -0.824 . . . . 0.0 109.778 179.643 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -75.68 -27.79 58.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.431 -0.793 . . . . 0.0 110.028 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.9 t -61.83 -60.44 3.64 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.319 -0.863 . . . . 0.0 110.168 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.406 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 0.8 OUTLIER -53.33 -34.89 59.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.359 -0.838 . . . . 0.0 110.105 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 48.9 mt -79.97 -26.22 40.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.355 -0.84 . . . . 0.0 110.273 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -110.15 33.25 4.56 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.407 -0.808 . . . . 0.0 110.337 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.439 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.6 t-160 -146.39 43.54 1.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.331 -0.855 . . . . 0.0 110.081 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.3 ttp85 -75.36 -31.5 60.55 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.443 -0.786 . . . . 0.0 110.297 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.07 -34.43 70.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.225 -0.922 . . . . 0.0 110.402 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.439 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -84.93 -42.43 14.98 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.094 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.1 -37.37 86.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.385 -0.822 . . . . 0.0 110.19 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -76.09 -32.07 59.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.79 . . . . 0.0 110.073 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -64.78 -49.66 69.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.43 -0.794 . . . . 0.0 110.128 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -84.55 -55.72 3.98 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.381 -0.825 . . . . 0.0 110.066 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.405 ' CD1' HG13 ' A' ' 25' ' ' ILE . 14.9 mm -98.95 158.19 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.292 -0.88 . . . . 0.0 109.995 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.561 ' O ' ' C ' ' A' ' 22' ' ' THR . 50.9 mttt -154.14 141.52 19.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.477 -0.765 . . . . 0.0 109.481 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.561 ' C ' ' O ' ' A' ' 21' ' ' LYS . 67.9 p -24.63 96.5 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 121.47 0.652 . . . . 0.0 110.893 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 42.7 m -163.36 -175.84 4.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.548 -0.72 . . . . 0.0 110.157 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 11.2 t80 -33.08 -37.26 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.894 -0.504 . . . . 0.0 112.092 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.445 HD13 HG21 ' A' ' 25' ' ' ILE . 46.2 mm -54.63 -65.78 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.047 -1.033 . . . . 0.0 109.994 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -76.43 -34.47 58.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.349 -0.844 . . . . 0.0 110.374 179.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -57.32 -41.88 80.8 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.364 -0.835 . . . . 0.0 110.553 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -75.01 -50.37 16.76 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.308 -0.87 . . . . 0.0 110.37 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 mpp? -60.02 -50.33 74.14 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.338 -0.851 . . . . 0.0 110.437 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 98.6 mt -61.35 -28.66 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.459 -0.776 . . . . 0.0 110.297 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.0 m -90.32 -23.0 21.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.353 -0.842 . . . . 0.0 110.354 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -59.72 -21.48 60.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.332 -0.855 . . . . 0.0 110.421 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.24 -16.59 2.1 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 7.4 m-30 -53.15 -71.56 0.07 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.147 -1.208 . . . . 0.0 110.247 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.512 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 4.0 mm? -108.12 164.12 12.57 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 109.908 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 p -62.53 144.33 56.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.376 -0.827 . . . . 0.0 110.197 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.5 mp -69.53 -22.97 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.24 -179.928 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -57.02 -27.88 62.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.297 -0.877 . . . . 0.0 110.316 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -62.34 -37.46 85.72 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.38 -0.825 . . . . 0.0 110.077 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.55 -33.11 72.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.412 -0.805 . . . . 0.0 110.201 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -69.0 -31.13 69.73 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.316 -0.865 . . . . 0.0 110.229 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -84.87 -59.47 2.34 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 110.377 -179.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 88.7 t -48.5 -33.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.501 -0.749 . . . . 0.0 110.786 -179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -44.97 -45.43 10.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.554 -0.716 . . . . 0.0 111.421 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -144.49 15.2 1.62 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.092 -1.005 . . . . 0.0 111.125 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.602 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 3.0 tm-20 -79.94 -48.09 1.38 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.116 -0.99 . . . . 0.0 110.891 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.602 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -75.49 166.78 27.94 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.121 1.063 . . . . 0.0 110.522 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.3 m -136.44 -42.93 0.62 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.438 -0.789 . . . . 0.0 110.174 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -96.2 -159.23 0.71 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.35 -0.844 . . . . 0.0 110.129 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -64.06 -14.58 55.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.313 -0.867 . . . . 0.0 110.641 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -55.96 -19.96 14.39 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.271 -0.893 . . . . 0.0 110.721 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -49.69 -49.68 46.7 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.342 -0.849 . . . . 0.0 110.496 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.428 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -75.27 -42.98 53.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.396 -0.815 . . . . 0.0 110.323 -179.97 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.43 -34.06 4.41 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.254 -0.904 . . . . 0.0 110.801 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 19.0 ttt -85.03 -24.75 28.05 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.306 -0.872 . . . . 0.0 110.019 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 4.8 tp -82.01 -46.85 13.39 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.374 -0.828 . . . . 0.0 110.72 -179.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.452 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.9 mp -68.63 -32.4 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.272 -0.893 . . . . 0.0 110.242 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp -71.04 -39.45 72.29 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.238 -0.914 . . . . 0.0 110.062 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.0 mmt -58.89 -29.24 66.87 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.355 -0.84 . . . . 0.0 110.338 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 92.9 mt -67.08 -59.9 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.368 -0.833 . . . . 0.0 110.078 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.406 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 1.7 mm? -69.25 -38.75 78.61 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.447 -0.783 . . . . 0.0 110.483 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -59.87 -25.37 65.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.323 -0.861 . . . . 0.0 110.387 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.9 tptp -73.54 -65.43 0.82 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.44 169.95 21.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 110.376 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -83.9 -26.09 29.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.769 . . . . 0.0 110.14 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.01 -40.78 98.8 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.369 -0.832 . . . . 0.0 110.008 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.4 t -60.06 -33.28 71.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.29 -0.881 . . . . 0.0 110.12 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 26.7 t80 -65.73 -40.96 92.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.39 -0.819 . . . . 0.0 109.892 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.2 -41.38 83.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.387 -0.821 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.2 t -64.11 -32.7 74.36 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.351 -0.843 . . . . 0.0 110.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 7.8 t80 -57.97 -42.19 84.52 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.4 -0.813 . . . . 0.0 109.89 179.816 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.439 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 36.3 t80 -62.6 -37.95 88.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.389 -0.82 . . . . 0.0 110.251 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -76.96 -32.93 57.63 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.463 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.58 -30.48 71.35 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 110.247 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.414 HD21 ' CD2' ' A' ' 80' ' ' TYR . 6.4 mt -84.98 -39.63 17.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.404 -0.81 . . . . 0.0 110.339 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.426 HD13 ' CD1' ' A' ' 72' ' ' TYR . 24.1 mt -68.85 -15.51 63.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.343 -0.848 . . . . 0.0 110.601 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.9 -21.1 64.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.267 -0.896 . . . . 0.0 110.622 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -109.66 -75.34 0.63 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.176 -0.952 . . . . 0.0 110.499 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.15 35.5 0.1 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.414 ' CD2' HD21 ' A' ' 75' ' ' LEU . 17.5 m-85 -98.35 16.43 21.59 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.378 -1.072 . . . . 0.0 110.438 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.1 tttm -44.98 -29.79 0.9 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -0.784 . . . . 0.0 110.831 -179.787 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -73.64 -45.16 54.45 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 109.794 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -78.88 -40.19 33.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.505 -0.747 . . . . 0.0 109.861 179.776 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.423 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . . . -65.24 -31.23 72.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.379 -0.826 . . . . 0.0 110.097 179.875 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -68.8 -34.87 76.24 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.45 -0.781 . . . . 0.0 110.21 179.927 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.9 tp -60.0 -45.76 91.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.382 -0.824 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mt -77.38 -24.59 50.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.349 -0.844 . . . . 0.0 110.441 -179.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.439 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 33.2 t-80 -79.11 -42.51 26.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.264 -0.897 . . . . 0.0 110.488 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -60.76 -19.92 60.23 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.309 -0.87 . . . . 0.0 110.494 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -86.63 -19.26 56.94 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.574 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 78.7 mt -61.95 -51.14 77.43 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.187 -1.184 . . . . 0.0 110.728 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.574 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.6 Cg_endo -71.72 -85.17 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.211 0 O-C-N 123.116 1.061 . . . . 0.0 110.635 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.4 t -135.19 146.78 29.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.097 -1.002 . . . . 0.0 110.125 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.3 t -116.17 -26.69 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.37 -0.831 . . . . 0.0 110.224 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 39.6 t -59.84 -49.08 79.09 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.276 -0.89 . . . . 0.0 110.362 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 1.2 m -75.65 -54.95 6.15 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.337 -0.852 . . . . 0.0 110.185 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.0 t . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.195 179.999 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ttm . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.164 0.506 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -115.3 144.62 43.47 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 110.277 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.22 -25.0 59.41 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.403 -0.81 . . . . 0.0 110.295 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -60.25 -31.62 70.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.253 -0.904 . . . . 0.0 110.391 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -72.73 -39.3 67.0 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.351 -0.843 . . . . 0.0 110.07 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 11.7 ttt-85 -69.08 -26.28 64.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.514 -0.741 . . . . 0.0 110.187 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -76.08 -31.5 58.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.5 t -60.79 -56.3 22.81 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.371 -0.83 . . . . 0.0 110.173 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -55.31 -38.76 69.1 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.349 -0.844 . . . . 0.0 110.176 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 84.8 mt -63.12 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.374 -0.829 . . . . 0.0 110.178 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -108.21 7.64 27.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.36 -0.837 . . . . 0.0 110.59 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.466 ' CE1' ' HG ' ' A' ' 86' ' ' LEU . 23.3 t-160 -103.86 32.35 3.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.171 -0.956 . . . . 0.0 109.92 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -75.06 -24.81 58.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.473 -0.767 . . . . 0.0 110.465 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -53.63 -35.74 61.28 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.194 -0.942 . . . . 0.0 110.379 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.406 ' HB2' ' NE2' ' A' ' 12' ' ' HIS . . . -85.83 -51.59 6.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.404 -0.81 . . . . 0.0 110.038 179.781 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 64.4 tp -57.44 -30.05 64.69 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 110.255 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -85.4 -33.16 22.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.435 -0.791 . . . . 0.0 110.371 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -67.5 -57.08 7.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.361 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -81.76 -65.2 1.04 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 110.391 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 14.8 mm -79.27 162.4 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.287 -0.883 . . . . 0.0 110.18 -179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.571 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.9 mttt -156.28 141.2 17.18 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.571 ' C ' ' O ' ' A' ' 21' ' ' LYS . 62.8 p -24.97 96.2 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.692 -0.63 . . . . 0.0 110.849 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.433 ' N ' ' O ' ' A' ' 21' ' ' LYS . 23.1 m -163.19 -175.96 4.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.617 -0.677 . . . . 0.0 110.304 -178.464 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.431 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.0 t80 -32.79 -40.56 0.05 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.831 -0.543 . . . . 0.0 112.176 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 41.5 mm -57.3 -65.71 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 120.918 -1.114 . . . . 0.0 110.029 -179.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 10.5 mtm -75.86 -37.4 58.99 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.385 -0.822 . . . . 0.0 110.073 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 4.5 t70 -57.88 -50.54 73.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.428 -0.795 . . . . 0.0 110.358 -179.884 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -55.59 -37.87 68.67 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.317 -0.864 . . . . 0.0 110.101 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.7 mtp -63.23 -38.43 91.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.409 -0.807 . . . . 0.0 110.131 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 93.7 mt -61.87 -36.61 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.029 179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.4 m -92.83 -19.78 21.37 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.301 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -56.22 -24.78 44.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.312 -0.868 . . . . 0.0 110.301 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.22 -12.34 3.82 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.408 ' CD1' ' HB2' ' A' ' 67' ' ' SER . 24.0 m-85 -67.53 -58.29 4.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.12 -1.224 . . . . 0.0 110.297 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.499 ' CD2' ' N ' ' A' ' 35' ' ' LEU . 3.9 mm? -109.58 165.14 11.89 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.326 -0.859 . . . . 0.0 110.225 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 42.8 p -65.14 163.56 14.77 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.079 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.1 mt -84.83 -27.87 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.284 -0.885 . . . . 0.0 110.177 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.5 m -62.35 -25.45 67.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.357 -0.839 . . . . 0.0 110.261 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.49 -29.31 65.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.833 . . . . 0.0 110.243 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.31 -53.89 52.19 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.326 -0.859 . . . . 0.0 110.25 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -59.63 -25.55 64.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.316 -0.865 . . . . 0.0 110.199 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -76.46 -64.54 1.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.331 -0.856 . . . . 0.0 110.159 179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 59.1 t -49.88 -33.65 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.493 -0.754 . . . . 0.0 110.699 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -42.13 -38.9 1.82 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.631 -0.668 . . . . 0.0 111.728 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -145.26 21.82 1.54 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.998 -1.064 . . . . 0.0 111.183 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.425 ' N ' ' HD2' ' A' ' 47' ' ' PRO . 2.2 tm-20 -79.02 -55.62 0.92 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 120.993 -1.067 . . . . 0.0 110.423 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.425 ' HD2' ' N ' ' A' ' 46' ' ' GLU . 50.3 Cg_endo -75.67 170.05 21.01 Favored 'Trans proline' 0 C--N 1.313 -1.327 0 O-C-N 123.545 1.287 . . . . 0.0 110.553 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.6 m -136.51 -40.07 0.64 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 110.358 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -95.27 -161.76 0.89 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.851 . . . . 0.0 110.311 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -61.11 -16.63 46.26 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 110.64 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -56.7 -19.07 14.72 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.221 -0.924 . . . . 0.0 110.674 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 73.0 ttt180 -50.6 -64.95 0.65 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.266 -0.897 . . . . 0.0 110.65 -179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.472 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -61.98 -51.88 66.28 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -44.35 -46.37 9.31 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.483 -0.76 . . . . 0.0 111.091 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.6 tpt -67.01 -28.48 68.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.097 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.3 tp -81.93 -35.58 28.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.326 -0.859 . . . . 0.0 110.71 -179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.472 HG12 ' O ' ' A' ' 53' ' ' ALA . 3.3 mm -60.49 -36.27 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.216 -0.927 . . . . 0.0 110.504 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.1 mttp -70.1 -46.35 65.02 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.276 -0.89 . . . . 0.0 110.675 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 0.438 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.3 OUTLIER -56.2 -24.92 44.96 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.166 -0.958 . . . . 0.0 110.652 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 95.3 mt -69.71 -57.48 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.229 -0.919 . . . . 0.0 109.68 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -78.06 -35.52 49.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.563 -0.711 . . . . 0.0 110.854 -179.591 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.73 -26.27 65.5 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -65.04 0.73 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.289 -0.882 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -160.1 169.12 24.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.253 -0.904 . . . . 0.0 110.268 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -82.92 -26.4 31.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.39 -0.819 . . . . 0.0 110.237 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -63.66 -39.48 94.45 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 110.24 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.408 ' HB2' ' CD1' ' A' ' 34' ' ' PHE . 12.1 t -60.54 -31.27 70.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.286 -179.928 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.425 ' CE2' HG12 ' A' ' 91' ' ' ILE . 1.9 t80 -62.99 -43.03 99.92 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.371 -0.831 . . . . 0.0 109.957 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.46 -37.15 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.0 t -67.47 -35.2 78.72 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.323 -0.861 . . . . 0.0 109.968 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.415 ' CE2' HD22 ' A' ' 87' ' ' LEU . 6.3 t80 -59.26 -29.9 67.89 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.41 -0.806 . . . . 0.0 109.8 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -70.35 -49.84 45.17 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.366 -0.834 . . . . 0.0 110.239 179.951 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -73.81 -29.36 62.12 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.341 -0.849 . . . . 0.0 110.452 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.31 76.77 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.339 -0.851 . . . . 0.0 110.281 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 21.3 mt -84.15 -36.37 22.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.376 -0.828 . . . . 0.0 110.28 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 26.6 mt -67.43 -14.83 63.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.404 -0.81 . . . . 0.0 110.54 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -54.35 -24.0 17.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.272 -0.892 . . . . 0.0 110.69 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.64 -75.05 0.61 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.271 -0.893 . . . . 0.0 110.174 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.36 55.17 0.18 Allowed Glycine 0 N--CA 1.492 2.406 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -107.5 16.17 24.09 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -1.059 . . . . 0.0 110.575 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 26.0 ttmt -47.35 -34.96 7.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.274 -0.891 . . . . 0.0 110.77 -179.755 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -48.99 36.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.362 -0.836 . . . . 0.0 109.86 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 tt -69.37 -49.89 51.26 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 109.991 179.747 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.69 -28.33 69.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.461 -0.774 . . . . 0.0 110.171 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -59.83 -42.29 93.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.835 . . . . 0.0 110.195 179.918 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.466 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 48.1 tp -65.39 -30.79 71.64 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.371 -0.831 . . . . 0.0 110.191 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.415 HD22 ' CE2' ' A' ' 71' ' ' PHE . 1.1 mt -81.82 -27.89 33.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.399 -0.813 . . . . 0.0 110.109 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -77.53 -45.97 23.81 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.421 -0.8 . . . . 0.0 110.284 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.17 -19.96 65.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.355 -0.841 . . . . 0.0 110.328 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -81.01 -17.35 72.49 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.52 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 27.8 mt -65.62 -54.67 28.4 Favored Pre-proline 0 N--CA 1.493 1.69 0 O-C-N 121.19 -1.183 . . . . 0.0 110.68 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.52 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 45.2 Cg_endo -71.08 -49.77 0.36 Allowed 'Trans proline' 0 C--N 1.314 -1.258 0 O-C-N 123.331 1.174 . . . . 0.0 110.684 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.9 t -117.5 140.83 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.303 -0.873 . . . . 0.0 110.192 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.0 t -119.35 -9.41 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.393 -0.817 . . . . 0.0 110.529 -179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 28.9 t -61.04 -69.27 0.24 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.218 -0.926 . . . . 0.0 110.263 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.3 m -100.68 -40.76 7.21 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.351 -0.843 . . . . 0.0 110.196 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.195 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.199 0.523 . . . . 0.0 110.253 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -152.8 155.25 36.78 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.39 -0.819 . . . . 0.0 110.236 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.8 -24.84 67.92 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.323 -0.861 . . . . 0.0 110.296 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -58.76 -41.88 87.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.305 -0.872 . . . . 0.0 110.265 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -60.13 -40.91 91.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.34 -0.85 . . . . 0.0 110.087 179.904 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -64.15 -39.51 94.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.381 -0.825 . . . . 0.0 110.013 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -70.76 -27.55 64.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.405 -0.809 . . . . 0.0 110.032 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 t -62.08 -59.42 5.1 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.398 -0.814 . . . . 0.0 110.149 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.421 ' CD2' ' CE1' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -52.51 -35.68 53.65 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.311 -0.868 . . . . 0.0 109.987 179.732 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 mt -80.75 -21.52 40.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.36 -0.837 . . . . 0.0 110.53 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -115.45 24.57 11.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.923 . . . . 0.0 110.483 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.422 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 8.2 t-80 -130.95 34.07 4.11 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.303 -0.873 . . . . 0.0 110.12 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.4 ttp-105 -71.27 -25.17 62.34 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.363 -0.836 . . . . 0.0 110.256 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.14 -34.14 69.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.238 -0.914 . . . . 0.0 110.158 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.422 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -77.95 -44.56 26.5 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.431 -0.793 . . . . 0.0 110.038 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.5 tp -65.28 -38.68 91.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.308 -0.87 . . . . 0.0 110.201 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.58 -42.99 79.61 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.324 -0.86 . . . . 0.0 110.12 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -81.75 -24.31 36.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.367 -0.833 . . . . 0.0 110.028 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -81.16 -64.86 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.285 -0.884 . . . . 0.0 110.179 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.4 ' CG2' ' N ' ' A' ' 21' ' ' LYS . 19.9 mt -128.59 163.17 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 0.0 110.404 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.56 ' O ' ' C ' ' A' ' 22' ' ' THR . 9.2 mttt -125.48 142.41 51.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.616 -0.677 . . . . 0.0 109.383 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.56 ' C ' ' O ' ' A' ' 21' ' ' LYS . 66.7 p -24.05 98.37 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.549 0.69 . . . . 0.0 111.075 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' TYR . 40.0 m -155.85 -175.81 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.638 . . . . 0.0 110.036 -178.609 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -33.01 -36.47 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.895 -0.503 . . . . 0.0 112.039 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.42 ' N ' ' O ' ' A' ' 23' ' ' SER . 42.9 mm -54.61 -65.17 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 120.99 -1.069 . . . . 0.0 110.221 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.41 -35.85 60.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.349 -0.845 . . . . 0.0 110.436 -179.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.18 -48.96 77.73 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.34 -0.85 . . . . 0.0 110.564 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -55.86 -40.5 73.0 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.224 -0.923 . . . . 0.0 110.509 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -61.36 -50.27 73.57 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.328 -0.858 . . . . 0.0 110.237 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 21.1 mt -58.97 -25.52 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.392 -0.817 . . . . 0.0 110.418 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.3 m -96.89 -14.69 21.63 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.355 -0.841 . . . . 0.0 110.573 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -74.98 -3.0 29.75 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.238 -0.914 . . . . 0.0 110.771 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.15 8.17 7.36 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.409 ' CD1' ' O ' ' A' ' 29' ' ' MET . 19.2 m-85 -80.38 -70.36 0.53 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.115 -1.227 . . . . 0.0 110.376 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.499 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 3.9 mm? -108.67 164.64 12.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.387 -0.82 . . . . 0.0 110.04 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.4 p -60.83 158.66 12.56 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.324 -0.86 . . . . 0.0 110.146 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -73.91 -28.15 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.364 -0.835 . . . . 0.0 110.136 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -59.96 -30.19 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.197 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.31 -26.85 63.97 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.387 -0.821 . . . . 0.0 110.212 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -68.39 -35.18 77.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.33 -0.856 . . . . 0.0 110.156 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -69.91 -30.63 68.1 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.388 -0.82 . . . . 0.0 110.075 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -66.62 -63.5 1.06 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 110.131 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 65.0 t -47.14 -33.56 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.45 -0.781 . . . . 0.0 110.644 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -46.55 -47.55 19.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.54 -0.725 . . . . 0.0 111.369 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -145.07 13.98 1.47 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.064 -1.022 . . . . 0.0 111.309 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.621 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 15.6 tp10 -80.59 -47.64 1.23 Allowed Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.043 -1.036 . . . . 0.0 110.974 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.621 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.7 Cg_endo -76.45 169.95 20.9 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.128 1.067 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.1 m -141.13 -46.8 0.39 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.372 -0.83 . . . . 0.0 110.169 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.76 -160.2 0.47 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.288 -0.882 . . . . 0.0 110.175 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -7.55 50.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.26 -0.9 . . . . 0.0 110.453 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -61.39 -17.12 52.59 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.157 -0.964 . . . . 0.0 110.447 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -50.22 -59.61 3.78 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.244 -0.91 . . . . 0.0 110.387 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.414 ' O ' ' CD1' ' A' ' 57' ' ' ILE . . . -66.08 -48.06 72.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.347 -0.846 . . . . 0.0 110.001 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -49.25 -34.07 14.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.421 -0.799 . . . . 0.0 110.487 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.9 ttt -79.55 -25.14 41.73 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.429 -0.794 . . . . 0.0 109.974 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.0 tp -79.16 -49.18 12.98 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.336 -0.853 . . . . 0.0 110.105 -179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.414 ' CD1' ' O ' ' A' ' 53' ' ' ALA . 2.5 mp -56.8 -30.9 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.318 -0.864 . . . . 0.0 109.997 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -75.15 -43.36 52.89 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.345 -0.847 . . . . 0.0 110.191 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 17.3 mmt -58.46 -30.96 67.35 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.419 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 81.7 mt -68.18 -58.0 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.02 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -68.66 -40.34 80.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.375 -0.828 . . . . 0.0 110.502 -179.74 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -55.58 -24.97 35.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.309 -0.869 . . . . 0.0 110.572 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -63.95 0.96 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.277 -0.89 . . . . 0.0 110.263 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -160.07 167.97 26.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.295 -0.878 . . . . 0.0 110.272 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -76.61 -36.46 57.46 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.17 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.37 -28.49 69.27 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.332 -0.855 . . . . 0.0 110.124 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 2.1 t -59.82 -48.58 81.11 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.38 -0.825 . . . . 0.0 110.139 179.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.421 ' CE1' ' CD2' ' A' ' 9' ' ' LEU . 4.0 t80 -57.71 -32.35 67.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.414 -0.804 . . . . 0.0 110.179 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.57 -44.09 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.333 -0.855 . . . . 0.0 109.939 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.4 t -65.51 -32.66 74.39 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.388 -0.82 . . . . 0.0 110.002 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -55.66 -41.54 73.79 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.339 -0.851 . . . . 0.0 109.857 179.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.428 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 38.4 t80 -62.71 -43.28 99.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.31 -0.869 . . . . 0.0 110.112 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -70.49 -24.83 62.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 110.404 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.88 -52.33 37.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.26 -0.9 . . . . 0.0 110.326 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.415 HD22 ' CG ' ' A' ' 80' ' ' TYR . 9.1 mt -62.72 -38.54 90.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.345 -0.847 . . . . 0.0 110.264 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.421 HD13 ' CD1' ' A' ' 72' ' ' TYR . 34.1 mt -66.91 -15.17 63.49 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.398 -0.814 . . . . 0.0 110.457 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.25 -22.93 66.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.25 -0.906 . . . . 0.0 110.478 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.69 -75.17 0.64 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.205 -0.935 . . . . 0.0 110.374 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.53 36.9 0.11 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.415 ' CG ' HD22 ' A' ' 75' ' ' LEU . 28.5 m-85 -92.9 16.38 12.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.493 -1.004 . . . . 0.0 110.441 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -42.4 -30.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.413 -0.804 . . . . 0.0 111.034 -179.725 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -78.83 -48.86 13.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.314 -0.866 . . . . 0.0 109.913 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.71 -48.59 37.54 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.013 179.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.52 -34.71 72.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.387 -0.82 . . . . 0.0 110.139 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.3 -36.1 77.12 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.358 -0.839 . . . . 0.0 110.082 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 39.3 tp -61.88 -40.32 95.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.302 -0.874 . . . . 0.0 110.327 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -74.95 -30.04 61.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.359 -0.838 . . . . 0.0 110.276 -179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.428 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 5.6 t60 -84.97 -27.03 26.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.472 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.75 -23.19 42.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.318 -0.864 . . . . 0.0 110.31 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -80.41 -24.96 58.02 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.525 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.5 mt -59.63 -56.08 39.4 Favored Pre-proline 0 N--CA 1.493 1.685 0 O-C-N 121.189 -1.183 . . . . 0.0 110.45 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.525 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo -70.82 -81.37 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.307 0 O-C-N 123.274 1.144 . . . . 0.0 110.705 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 67.5 t -70.92 166.67 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.181 -0.949 . . . . 0.0 110.08 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 59.0 t -99.64 -56.52 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.359 -0.838 . . . . 0.0 110.134 -179.919 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 9.9 t -124.67 -69.66 0.79 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.29 -0.881 . . . . 0.0 110.304 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.98 -53.89 1.05 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.318 -0.864 . . . . 0.0 110.302 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.0 p . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.19 -179.95 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 ttm . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.23 0.538 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -68.25 161.76 26.52 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.413 -0.805 . . . . 0.0 110.102 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.86 -24.98 58.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.401 -0.812 . . . . 0.0 110.414 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 ttmm -59.99 -34.98 74.05 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.349 -0.844 . . . . 0.0 110.552 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.43 82.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.234 -0.916 . . . . 0.0 110.139 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 56.0 ttp180 -64.77 -31.75 73.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.333 -0.854 . . . . 0.0 109.997 179.706 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -74.88 -27.65 60.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.427 -0.796 . . . . 0.0 109.818 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 t -62.01 -50.65 71.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.431 -0.793 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.409 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 2.1 tm? -59.38 -38.48 80.62 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.35 -0.844 . . . . 0.0 109.871 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 12.0 mt -72.5 -30.69 64.73 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.334 -0.854 . . . . 0.0 110.147 179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -81.97 -4.66 57.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.348 -0.845 . . . . 0.0 110.639 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.45 ' CD2' ' CB ' ' A' ' 15' ' ' ALA . 9.7 t-160 -96.38 34.01 1.69 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.233 -0.917 . . . . 0.0 110.25 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -75.8 -41.57 52.43 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.846 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.28 -35.67 27.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.208 -0.933 . . . . 0.0 110.953 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.45 ' CB ' ' CD2' ' A' ' 12' ' ' HIS . . . -75.13 -25.85 58.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.077 -1.015 . . . . 0.0 110.267 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.432 ' N ' ' CD2' ' A' ' 12' ' ' HIS . 7.1 tt -85.28 -29.28 24.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.87 . . . . 0.0 109.831 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.69 -38.19 86.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 ttmt -84.34 -31.54 24.74 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 110.345 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.411 ' CB ' HD23 ' A' ' 83' ' ' LEU . 59.1 m-20 -84.46 -65.54 1.0 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.312 -0.867 . . . . 0.0 110.364 -179.772 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 15.2 mm -108.99 109.56 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.388 -0.82 . . . . 0.0 110.224 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.559 ' O ' ' C ' ' A' ' 22' ' ' THR . 34.3 mtpt -100.56 141.4 33.47 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.509 -0.744 . . . . 0.0 109.438 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.559 ' C ' ' O ' ' A' ' 21' ' ' LYS . 73.2 p -25.02 97.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.302 0 CA-C-O 121.49 0.662 . . . . 0.0 111.122 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 7.8 t -160.34 -176.25 5.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.473 -0.767 . . . . 0.0 110.285 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 9.2 t80 -33.28 -39.25 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.859 -0.526 . . . . 0.0 111.866 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 46.2 mm -57.74 -64.1 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.044 -1.035 . . . . 0.0 110.029 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 7.5 mmt -75.23 -34.36 61.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.323 -0.861 . . . . 0.0 110.198 179.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -59.38 4.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.456 -0.777 . . . . 0.0 110.402 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 0.426 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . 11.4 t-80 -54.52 -24.92 22.75 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.329 -0.857 . . . . 0.0 110.474 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.41 ' O ' ' CD2' ' A' ' 34' ' ' PHE . 33.8 mtt -72.41 -38.58 68.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -0.909 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 82.5 mt -61.39 -50.18 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.248 -0.908 . . . . 0.0 110.049 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.8 m -74.76 -15.57 60.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 110.455 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.45 -25.49 50.84 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.276 -0.89 . . . . 0.0 110.431 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 139.45 -13.72 3.22 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.41 ' CD2' ' O ' ' A' ' 29' ' ' MET . 17.4 m-30 -58.56 -61.83 2.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.14 -1.212 . . . . 0.0 110.44 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 3.9 mp -125.46 165.19 18.89 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.264 -0.897 . . . . 0.0 110.423 -179.865 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 p -57.23 173.53 0.24 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.446 -0.784 . . . . 0.0 110.397 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 4.3 mp -85.35 -21.44 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.424 -0.797 . . . . 0.0 110.201 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.9 m -57.91 -27.21 63.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.279 -0.888 . . . . 0.0 110.315 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.391 -0.818 . . . . 0.0 110.149 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -62.12 -32.26 72.81 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.361 -0.837 . . . . 0.0 110.114 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.84 -32.13 69.06 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.391 -0.818 . . . . 0.0 110.167 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -75.58 -54.94 6.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.06 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.6 t -53.36 -33.85 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.379 -0.826 . . . . 0.0 110.47 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -46.7 -36.57 7.29 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.378 -0.826 . . . . 0.0 110.878 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -144.17 20.8 1.75 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.282 -0.886 . . . . 0.0 110.543 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.501 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.7 tt0 -81.91 -57.02 0.53 Allowed Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 0.0 110.741 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.501 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 46.7 Cg_endo -72.49 170.09 20.19 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 O-C-N 123.307 1.162 . . . . 0.0 110.631 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 27.0 m -140.79 -43.03 0.39 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.436 -0.79 . . . . 0.0 110.1 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -98.33 -154.35 0.46 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.443 -0.786 . . . . 0.0 110.055 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -66.61 -12.55 58.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.281 -0.887 . . . . 0.0 110.609 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -57.47 -19.29 23.27 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.246 -0.909 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 2.1 ttt85 -51.62 -36.41 45.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.275 -0.89 . . . . 0.0 110.715 -179.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.405 ' O ' HD11 ' A' ' 57' ' ' ILE . . . -85.98 -18.0 33.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 110.528 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -83.34 -34.49 25.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.179 -0.95 . . . . 0.0 110.287 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -77.52 -47.78 18.69 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.342 -0.849 . . . . 0.0 110.427 -179.666 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 17.7 tp -55.76 -40.76 73.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.355 -0.84 . . . . 0.0 110.548 -179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.564 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 0.9 OUTLIER -67.88 -26.4 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.337 -0.852 . . . . 0.0 109.957 179.885 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.3 mtmm -70.9 -48.76 51.92 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.233 -0.917 . . . . 0.0 109.924 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -52.77 -30.52 33.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.295 -0.878 . . . . 0.0 110.447 179.899 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 85.1 mt -63.88 -53.01 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.329 -0.857 . . . . 0.0 109.873 179.712 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.409 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.7 mm? -82.17 -27.31 32.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.458 -0.776 . . . . 0.0 110.699 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -60.74 -29.59 69.48 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.385 -0.822 . . . . 0.0 110.529 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -76.01 -65.07 0.96 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.24 -0.913 . . . . 0.0 110.389 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.28 169.99 22.05 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 0.0 110.218 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -80.58 -21.68 41.44 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.37 -0.831 . . . . 0.0 110.312 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -61.06 -39.37 89.59 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.18 -0.95 . . . . 0.0 110.232 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.4 t -60.11 -28.41 67.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.333 -0.854 . . . . 0.0 110.139 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 16.2 t80 -70.4 -35.83 73.7 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 109.954 179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.59 -41.68 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.118 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.3 t -63.73 -36.84 85.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.299 -0.876 . . . . 0.0 110.182 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.466 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 5.9 t80 -57.05 -38.3 73.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.398 -0.814 . . . . 0.0 110.175 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 35.2 t80 -64.23 -43.33 95.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 110.372 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -76.84 -25.4 53.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.366 -0.834 . . . . 0.0 110.477 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.19 -35.84 80.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.284 -0.885 . . . . 0.0 110.45 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.466 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 11.6 mt -80.22 -40.98 26.02 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.428 HD11 ' CE1' ' A' ' 72' ' ' TYR . 39.2 mt -66.58 -14.97 63.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.712 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -63.71 -22.78 67.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.244 -0.91 . . . . 0.0 110.547 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -109.91 -75.27 0.63 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.207 -0.933 . . . . 0.0 110.459 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.04 37.0 0.1 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -94.45 16.47 15.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.506 -0.996 . . . . 0.0 110.588 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 38.5 ttpt -41.49 -32.39 0.33 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.483 -0.761 . . . . 0.0 110.929 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -67.35 -47.42 70.49 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.344 -0.848 . . . . 0.0 109.63 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.411 HD23 ' CB ' ' A' ' 19' ' ' ASP . 1.1 tm? -69.94 -51.42 32.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.47 -0.769 . . . . 0.0 109.829 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.26 -30.04 69.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.44 -0.787 . . . . 0.0 110.202 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -58.83 -41.35 86.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.32 -0.863 . . . . 0.0 110.124 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.431 HD21 ' CE1' ' A' ' 12' ' ' HIS . 0.7 OUTLIER -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.356 -0.84 . . . . 0.0 110.173 179.934 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -70.34 -34.48 72.7 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.318 -0.864 . . . . 0.0 110.214 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.434 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 13.9 t-80 -77.87 -16.63 58.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.348 -0.845 . . . . 0.0 110.493 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.15 -14.97 45.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.293 -0.879 . . . . 0.0 110.545 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -109.58 -22.82 6.53 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.517 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 19.3 mt -59.93 -57.39 27.12 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.198 -1.177 . . . . 0.0 110.437 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.517 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.2 Cg_endo -70.83 -85.0 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.322 0 O-C-N 123.267 1.14 . . . . 0.0 110.564 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 62.6 t -140.06 167.3 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.104 -0.998 . . . . 0.0 109.96 179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 62.1 t -116.19 -25.9 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.287 -0.883 . . . . 0.0 110.354 -179.995 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.8 t -81.44 -71.61 0.47 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.332 -0.855 . . . . 0.0 110.266 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 74.3 p -60.51 -38.73 85.29 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.328 -0.857 . . . . 0.0 110.282 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 43.5 t . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.182 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtm . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.184 0.516 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 0.439 ' OD1' ' N ' ' A' ' 2' ' ' ASP . 36.8 p-10 -104.23 104.77 14.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.309 -0.869 . . . . 0.0 110.398 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.94 -37.65 61.94 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.348 -0.845 . . . . 0.0 110.271 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -58.16 -41.02 82.92 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.381 -0.824 . . . . 0.0 110.301 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.0 -41.18 82.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.335 -0.853 . . . . 0.0 110.091 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -66.82 -32.87 74.43 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.365 -0.834 . . . . 0.0 110.07 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -75.23 -27.78 59.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.344 -0.848 . . . . 0.0 110.283 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.3 t -60.68 -58.35 8.84 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.261 -0.899 . . . . 0.0 110.111 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.417 ' HG ' ' CD2' ' A' ' 61' ' ' LEU . 0.9 OUTLIER -57.58 -34.71 69.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.379 -0.826 . . . . 0.0 110.046 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.1 mt -81.27 -21.2 39.56 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.343 -0.848 . . . . 0.0 110.471 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -116.66 53.67 0.88 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.306 -0.871 . . . . 0.0 110.427 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.431 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.5 t-160 -159.78 42.37 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.333 -0.854 . . . . 0.0 109.772 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -75.15 -33.78 61.55 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.474 -0.766 . . . . 0.0 110.565 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -58.99 -35.49 73.31 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.217 -0.927 . . . . 0.0 110.23 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.431 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -85.43 -34.98 21.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.433 -0.792 . . . . 0.0 110.141 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.412 ' CD1' ' C ' ' A' ' 16' ' ' LEU . 3.0 tm? -64.1 -46.41 84.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.387 -0.821 . . . . 0.0 109.871 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -61.65 -43.52 98.7 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.492 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -66.11 -42.29 89.41 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.362 -0.836 . . . . 0.0 110.524 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.9 m-20 -80.28 -64.87 1.09 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.398 -0.814 . . . . 0.0 110.277 -179.87 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.9 mm -102.79 166.26 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.313 -0.867 . . . . 0.0 110.203 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.536 ' O ' ' C ' ' A' ' 22' ' ' THR . 38.9 mtmt -153.64 141.14 19.8 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.46 -0.775 . . . . 0.0 109.531 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.536 ' C ' ' O ' ' A' ' 21' ' ' LYS . 70.7 p -25.85 94.65 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 121.455 0.645 . . . . 0.0 111.175 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 21' ' ' LYS . 26.5 m -165.23 -175.85 3.82 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.632 -0.667 . . . . 0.0 109.923 -178.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.44 ' C ' ' O ' ' A' ' 23' ' ' SER . 7.9 t80 -33.66 -34.72 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.883 -0.511 . . . . 0.0 111.841 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.445 ' N ' ' O ' ' A' ' 23' ' ' SER . 44.2 mm -53.49 -65.46 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.063 -1.023 . . . . 0.0 110.027 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -75.78 -37.9 58.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.23 -0.918 . . . . 0.0 110.216 179.55 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -57.65 -50.37 73.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.7 -33.17 69.88 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.247 -0.908 . . . . 0.0 110.075 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.0 mtt -68.41 -58.08 4.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.512 -0.742 . . . . 0.0 110.008 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 8.3 mt -56.47 -27.33 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.392 -0.817 . . . . 0.0 110.07 179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 33.5 m -88.67 -22.62 23.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.344 -0.847 . . . . 0.0 110.261 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -59.76 -26.82 66.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.328 -0.858 . . . . 0.0 110.33 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.64 -15.2 2.91 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 25.0 m-85 -57.82 -47.67 81.95 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -1.175 . . . . 0.0 110.35 -179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 4.7 mp -132.07 165.13 24.7 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.347 -0.845 . . . . 0.0 110.387 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -70.43 171.85 9.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.39 -0.819 . . . . 0.0 110.265 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 49.4 mm -84.96 -18.77 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.824 . . . . 0.0 110.35 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.0 m -55.79 -26.25 45.21 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.24 -0.912 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.9 tt0 -73.64 -28.03 61.57 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -71.56 -41.69 68.75 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.363 -0.835 . . . . 0.0 110.246 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -64.15 -27.69 69.25 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.32 -0.862 . . . . 0.0 110.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -80.19 -60.98 2.12 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.173 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 65.3 t -48.41 -33.85 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.442 -0.787 . . . . 0.0 110.668 -179.966 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -46.62 -42.72 16.61 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.464 -0.772 . . . . 0.0 111.173 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -145.22 17.25 1.54 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.114 -0.991 . . . . 0.0 110.974 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.613 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.1 OUTLIER -79.55 -47.66 1.5 Allowed Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.048 -1.033 . . . . 0.0 110.721 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.613 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -77.13 170.08 20.31 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.262 1.138 . . . . 0.0 110.334 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.8 m -129.25 -41.46 1.4 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.386 -0.821 . . . . 0.0 110.355 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -98.41 -159.61 0.75 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.355 -0.84 . . . . 0.0 110.363 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -65.74 -12.13 51.35 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.369 -0.832 . . . . 0.0 110.715 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -55.63 -20.03 12.43 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.152 -0.967 . . . . 0.0 110.678 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 24.3 ttp180 -49.65 -37.43 28.28 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.177 -0.952 . . . . 0.0 110.592 -179.858 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -79.1 -53.04 7.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.367 -0.833 . . . . 0.0 110.113 179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -50.45 -26.47 5.12 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.44 -0.788 . . . . 0.0 110.619 -179.88 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.8 tpt -82.99 -28.04 29.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.318 -0.864 . . . . 0.0 110.241 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.0 tp -84.89 -50.85 7.17 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.399 -179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 2.7 mp -58.93 -36.66 62.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.328 -0.858 . . . . 0.0 110.072 -179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -66.56 -37.53 85.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.323 -0.861 . . . . 0.0 109.929 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.7 mmt -61.27 -27.79 68.71 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.413 -0.804 . . . . 0.0 110.14 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 87.0 mt -66.72 -53.62 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.354 -0.841 . . . . 0.0 109.889 179.787 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.417 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -77.47 -34.06 54.45 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.51 -0.744 . . . . 0.0 110.535 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -25.08 67.5 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.279 -0.888 . . . . 0.0 110.339 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -77.35 -64.51 1.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 110.355 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -153.6 166.49 32.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.388 -0.82 . . . . 0.0 110.371 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -85.21 -25.33 27.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.8 . . . . 0.0 110.246 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.48 -35.25 71.9 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.338 -0.851 . . . . 0.0 110.382 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.8 t -64.45 -34.07 77.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.354 -0.841 . . . . 0.0 110.127 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 18.5 t80 -60.58 -44.89 95.71 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.4 -0.812 . . . . 0.0 110.023 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.15 -34.29 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.804 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.8 t -73.58 -29.43 62.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.41 -0.806 . . . . 0.0 109.978 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.454 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 10.4 t80 -57.47 -44.54 84.93 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.499 -0.751 . . . . 0.0 109.771 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.421 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 46.3 t80 -61.05 -45.79 93.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.459 -0.776 . . . . 0.0 110.072 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -76.42 -23.58 53.99 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.351 -0.843 . . . . 0.0 110.577 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.89 -32.01 70.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.454 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 3.9 mt -84.9 -39.23 18.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.204 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.404 HD12 ' CE1' ' A' ' 72' ' ' TYR . 23.0 mt -67.2 -14.73 63.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.408 -0.808 . . . . 0.0 110.524 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 -56.78 -24.75 52.65 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.0 110.643 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -116.78 -75.08 0.58 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.167 -0.958 . . . . 0.0 110.394 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.37 67.35 0.14 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -125.08 16.37 8.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.406 -1.056 . . . . 0.0 110.509 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ttmt -44.34 -30.93 0.91 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.473 -0.767 . . . . 0.0 110.96 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.61 -49.12 67.34 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.355 -0.841 . . . . 0.0 109.791 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -78.84 -40.49 32.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.427 -0.795 . . . . 0.0 109.798 179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.37 -45.91 91.83 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.1 -29.21 70.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.334 -0.854 . . . . 0.0 110.07 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 23.2 tp -59.99 -50.19 74.72 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.446 -0.783 . . . . 0.0 110.212 179.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 mp -77.4 -25.3 50.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.258 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.421 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 2.0 t60 -68.74 -41.11 79.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.303 -0.873 . . . . 0.0 110.359 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.62 -22.19 64.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.259 -0.901 . . . . 0.0 110.543 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -84.9 -19.71 59.03 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.521 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.8 mt -60.67 -53.91 59.83 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.171 -1.193 . . . . 0.0 110.576 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.521 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.4 Cg_endo -71.26 -88.66 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 123.271 1.143 . . . . 0.0 110.547 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 48.5 t -145.84 147.75 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.169 -0.957 . . . . 0.0 109.92 179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 63.1 t -78.29 -26.37 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.412 -0.805 . . . . 0.0 110.292 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 6.1 t -98.62 -15.99 19.25 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.897 . . . . 0.0 110.715 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.54 5.08 20.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.146 -0.972 . . . . 0.0 110.81 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.069 -1.019 . . . . 0.0 110.164 179.997 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.209 0.528 . . . . 0.0 110.241 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -133.9 107.61 7.94 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.391 -0.818 . . . . 0.0 110.118 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.21 -24.95 57.83 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.317 -0.864 . . . . 0.0 110.458 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -55.08 -34.64 63.78 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.283 -0.886 . . . . 0.0 110.379 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.56 -39.04 92.38 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -63.8 -30.24 71.36 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.388 -0.82 . . . . 0.0 109.851 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -72.82 -37.14 67.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.493 -0.754 . . . . 0.0 109.959 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.8 t -63.27 -50.18 71.15 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.374 -0.829 . . . . 0.0 110.156 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -60.18 -36.58 77.92 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.277 -0.889 . . . . 0.0 109.913 179.824 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.9 mt -68.23 -31.04 70.25 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.85 . . . . 0.0 109.961 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -97.07 22.9 7.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.403 -0.81 . . . . 0.0 110.16 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.431 ' CE1' ' HG ' ' A' ' 87' ' ' LEU . 6.8 t60 -107.97 23.25 14.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.898 . . . . 0.0 110.331 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 49.1 ttp180 -67.94 -47.5 68.53 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.232 -0.917 . . . . 0.0 110.003 179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.71 -35.38 77.88 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.362 -0.836 . . . . 0.0 110.111 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 0.416 ' HB2' ' CD2' ' A' ' 12' ' ' HIS . . . -78.81 -43.87 24.37 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.399 -0.813 . . . . 0.0 110.074 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.46 ' C ' ' CD1' ' A' ' 16' ' ' LEU . 2.3 tm? -59.09 -50.36 74.36 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.296 -0.878 . . . . 0.0 109.692 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.91 -54.07 51.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.335 -0.853 . . . . 0.0 110.225 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -61.84 -27.55 68.86 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.29 -0.881 . . . . 0.0 110.167 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.406 ' HB3' ' CD1' ' A' ' 83' ' ' LEU . 63.6 m-20 -85.1 -65.19 1.04 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.41 -0.806 . . . . 0.0 110.317 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.435 ' CD1' HG13 ' A' ' 25' ' ' ILE . 22.1 mt -134.38 147.12 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.307 -0.87 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.58 ' O ' ' C ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -106.44 141.98 36.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.562 -0.711 . . . . 0.0 109.298 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.58 ' C ' ' O ' ' A' ' 21' ' ' LYS . 81.8 p -24.17 98.49 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.493 0.663 . . . . 0.0 110.891 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 24' ' ' TYR . 3.3 m -152.22 -175.68 5.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.69 -0.631 . . . . 0.0 110.183 -178.51 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.425 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -32.91 -37.43 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.896 -0.503 . . . . 0.0 112.064 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.435 HG13 ' CD1' ' A' ' 20' ' ' ILE . 44.3 mm -52.45 -65.25 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.901 -1.125 . . . . 0.0 110.169 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 0.42 ' O ' HG12 ' A' ' 30' ' ' ILE . 2.1 mpt? -75.16 -50.49 16.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.891 . . . . 0.0 110.392 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -47.44 -51.53 19.86 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.526 -0.734 . . . . 0.0 111.228 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -55.26 -40.09 70.56 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.193 -0.942 . . . . 0.0 110.181 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 42.9 mtp -68.11 -32.52 72.87 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.398 -0.814 . . . . 0.0 110.433 179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 0.42 HG12 ' O ' ' A' ' 26' ' ' MET . 39.7 mm -61.94 -65.43 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.34 -0.85 . . . . 0.0 110.405 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.2 m -59.94 -19.27 51.0 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.426 -0.796 . . . . 0.0 110.691 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -22.37 32.29 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.18 -0.95 . . . . 0.0 110.407 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.86 -14.53 3.35 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.43 ' N ' ' CD1' ' A' ' 34' ' ' PHE . 15.0 m-30 -60.91 -67.76 0.37 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.177 -1.19 . . . . 0.0 110.441 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 0.48 ' N ' ' CD2' ' A' ' 35' ' ' LEU . 3.8 mm? -113.25 150.05 32.94 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 110.251 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.8 p -62.58 175.18 0.83 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.393 -0.817 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.7 mp -77.68 -15.64 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.426 -0.797 . . . . 0.0 110.497 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.3 m -61.77 -31.25 71.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.236 -0.915 . . . . 0.0 110.415 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -70.92 -31.05 67.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.329 -0.857 . . . . 0.0 110.274 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -75.16 -27.67 59.81 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.34 -0.85 . . . . 0.0 110.433 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.76 -35.53 77.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.183 -0.948 . . . . 0.0 110.362 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -77.7 -59.75 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.228 -0.92 . . . . 0.0 110.265 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 78.8 t -47.42 -33.44 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.406 -0.809 . . . . 0.0 110.593 179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -46.67 -53.17 12.22 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.588 -0.695 . . . . 0.0 111.505 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.82 4.75 2.57 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.05 -1.031 . . . . 0.0 111.645 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.56 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.9 tp10 -75.2 -47.49 4.49 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 120.917 -1.115 . . . . 0.0 110.884 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.56 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.0 Cg_endo -74.84 169.99 21.36 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.189 1.099 . . . . 0.0 110.455 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -152.65 -50.37 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.376 -0.827 . . . . 0.0 110.103 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.05 -160.71 0.3 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.379 -0.826 . . . . 0.0 110.076 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -66.76 -13.82 61.87 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.417 -0.802 . . . . 0.0 110.501 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -62.76 -16.29 57.18 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.494 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -51.82 -60.66 2.91 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.249 -0.907 . . . . 0.0 110.518 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.426 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -72.7 -48.37 39.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.324 -0.86 . . . . 0.0 110.299 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.76 -35.53 6.27 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.434 -0.791 . . . . 0.0 110.781 -179.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -82.05 -25.02 34.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.364 -0.835 . . . . 0.0 109.932 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 32.3 tp -80.17 -39.4 29.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 0.0 110.23 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.426 HG12 ' O ' ' A' ' 53' ' ' ALA . 32.7 mm -63.37 -38.74 82.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 109.933 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.74 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 109.74 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.7 mmt -59.43 -27.81 66.38 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.404 -0.81 . . . . 0.0 110.012 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 91.5 mt -66.99 -49.81 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.515 -0.741 . . . . 0.0 109.959 179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -80.69 -29.21 36.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.475 -0.766 . . . . 0.0 110.635 -179.714 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -61.28 -28.92 69.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.317 -0.864 . . . . 0.0 110.451 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -65.27 0.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.386 -0.821 . . . . 0.0 110.249 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -160.24 170.1 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.397 -0.815 . . . . 0.0 110.187 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -81.31 -28.87 34.41 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.382 -0.824 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -61.69 -36.85 82.08 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.351 -0.843 . . . . 0.0 110.251 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 t -59.8 -37.46 79.18 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 11.6 t80 -60.31 -36.29 77.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.328 -0.857 . . . . 0.0 109.862 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.7 t -65.23 -35.58 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.42 -0.8 . . . . 0.0 109.856 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.1 t -69.58 -37.11 76.83 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.401 -0.812 . . . . 0.0 110.046 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.431 ' CE1' HD11 ' A' ' 75' ' ' LEU . 21.5 t80 -52.41 -39.67 61.21 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.429 -0.795 . . . . 0.0 109.918 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 47.2 t80 -62.46 -51.95 65.48 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.996 179.794 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -72.68 -20.6 61.21 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.324 -0.86 . . . . 0.0 110.562 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.78 -41.28 83.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.26 -0.9 . . . . 0.0 110.368 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.431 HD11 ' CE1' ' A' ' 71' ' ' PHE . 2.1 mt -80.03 -35.72 36.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.326 -0.858 . . . . 0.0 110.196 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 32.2 mt -65.0 -15.55 62.42 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.391 -0.818 . . . . 0.0 110.389 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -58.19 -21.36 47.2 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.203 -0.935 . . . . 0.0 110.467 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -116.96 -75.05 0.58 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.337 -0.852 . . . . 0.0 110.288 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.59 67.74 0.12 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 12.3 m-85 -125.14 16.39 8.44 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.409 -1.053 . . . . 0.0 110.565 -179.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 67.3 tttt -45.0 -37.55 4.12 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.319 -0.863 . . . . 0.0 110.814 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.64 -44.54 77.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.279 -0.888 . . . . 0.0 109.734 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.406 ' CD1' ' HB3' ' A' ' 19' ' ' ASP . 4.2 tt -70.24 -53.88 15.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.454 -0.779 . . . . 0.0 109.796 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.75 -26.58 67.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.431 -0.793 . . . . 0.0 110.322 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.36 -43.93 96.06 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.346 -0.846 . . . . 0.0 110.154 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.412 ' CD1' ' C ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.54 -43.13 99.42 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.363 -0.835 . . . . 0.0 109.852 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.431 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 0.9 OUTLIER -73.33 -34.16 65.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.401 -0.812 . . . . 0.0 110.296 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 54.3 t-80 -70.01 -48.1 59.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.415 -0.803 . . . . 0.0 110.168 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.62 -18.93 61.48 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.361 -0.837 . . . . 0.0 110.405 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.45 -21.81 53.02 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.574 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 57.3 mt -59.26 -52.55 73.66 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.223 -1.163 . . . . 0.0 110.594 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.574 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.9 Cg_endo -72.12 -81.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.293 0 O-C-N 123.328 1.173 . . . . 0.0 110.755 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 59.4 t -146.06 141.82 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.066 -1.021 . . . . 0.0 110.13 -179.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 62.3 t -94.28 -25.23 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.347 -0.845 . . . . 0.0 110.163 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.8 t -58.81 -25.71 63.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.303 -0.873 . . . . 0.0 110.387 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.61 5.07 15.31 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.305 -0.872 . . . . 0.0 110.633 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.236 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.189 0.519 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -138.53 149.84 45.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.311 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.5 -24.6 56.88 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.381 -0.824 . . . . 0.0 110.325 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.5 ttmt -51.08 -39.15 55.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.348 -0.845 . . . . 0.0 110.784 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -64.12 -41.23 97.32 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.242 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -67.39 -30.63 70.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.313 -0.867 . . . . 0.0 110.052 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -72.07 -27.43 62.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.375 -0.828 . . . . 0.0 110.062 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -63.21 -56.5 16.15 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.426 -0.796 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -62.06 -34.8 76.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.414 -0.804 . . . . 0.0 109.777 179.844 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.5 mt -65.79 -33.67 76.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.34 -0.85 . . . . 0.0 110.014 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -94.04 18.9 9.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.333 -0.854 . . . . 0.0 110.267 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.422 ' CG ' HD21 ' A' ' 87' ' ' LEU . 52.0 t60 -103.45 26.24 8.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.924 . . . . 0.0 110.055 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -75.07 -50.47 16.33 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 110.063 -179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.94 -33.78 70.99 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.379 -0.826 . . . . 0.0 110.307 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -46.97 26.25 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.359 -0.838 . . . . 0.0 110.058 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -57.44 -41.55 80.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.396 -0.815 . . . . 0.0 110.185 -179.99 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.32 -45.4 76.33 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.34 -0.85 . . . . 0.0 110.454 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -85.2 -23.42 28.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.27 -0.893 . . . . 0.0 110.495 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -74.11 -65.24 0.87 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.303 -0.873 . . . . 0.0 110.419 -179.707 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 24.1 mt -146.9 143.35 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.322 -0.862 . . . . 0.0 110.558 -179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.57 ' O ' ' C ' ' A' ' 22' ' ' THR . 8.4 mttt -94.78 142.57 27.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.589 -0.695 . . . . 0.0 109.162 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.57 ' C ' ' O ' ' A' ' 21' ' ' LYS . 80.9 p -23.5 97.58 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.618 -0.676 . . . . 0.0 110.921 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.2 t -146.32 -176.02 5.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.628 -0.67 . . . . 0.0 110.38 -178.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' SER . 13.8 t80 -33.15 -37.98 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.963 -0.46 . . . . 0.0 111.941 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.3 mm -57.5 -65.56 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.99 -1.069 . . . . 0.0 109.859 179.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 11.4 mmt -75.73 -25.27 56.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.459 -0.776 . . . . 0.0 110.323 179.648 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -71.15 -54.51 10.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.414 -0.804 . . . . 0.0 110.412 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.88 -32.62 63.86 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.292 -0.88 . . . . 0.0 110.378 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.8 mtp -62.48 -44.31 96.69 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 110.326 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.6 mt -63.82 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.397 -0.814 . . . . 0.0 110.199 -179.863 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.4 m -79.53 -25.12 41.78 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.34 -0.85 . . . . 0.0 110.328 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.96 -20.72 55.05 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.242 -0.911 . . . . 0.0 110.363 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.07 -13.48 3.07 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 7.9 m-30 -54.17 -66.6 0.37 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.207 -1.172 . . . . 0.0 110.4 -179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 6.3 mp -128.34 165.19 21.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.358 -0.839 . . . . 0.0 110.212 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.7 p -56.31 154.4 8.23 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.399 -0.813 . . . . 0.0 110.396 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 3.2 mp -77.16 -23.66 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.405 -0.81 . . . . 0.0 110.32 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.1 m -64.59 -37.34 87.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.384 -0.822 . . . . 0.0 110.169 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.1 -25.58 65.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.257 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -74.95 -31.88 61.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.302 -0.874 . . . . 0.0 110.412 -179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.76 -32.42 72.99 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.336 -0.853 . . . . 0.0 110.306 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.23 -40.09 78.13 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.363 -0.835 . . . . 0.0 110.11 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.9 t -59.36 -34.35 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.366 -0.834 . . . . 0.0 110.265 179.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.07 -30.75 6.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.502 -0.749 . . . . 0.0 111.04 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -145.2 20.25 1.57 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.218 -0.926 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.524 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 10.3 tt0 -79.92 -57.24 0.69 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.096 -1.003 . . . . 0.0 110.355 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.524 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 47.7 Cg_endo -72.99 170.26 20.21 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 O-C-N 123.347 1.183 . . . . 0.0 110.52 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.8 m -131.07 -41.8 1.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -87.85 -162.38 0.81 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.362 -0.836 . . . . 0.0 110.224 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -71.46 -9.18 57.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.337 -0.852 . . . . 0.0 110.568 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -60.25 -17.51 42.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.544 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -50.94 -49.53 59.61 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.213 -0.929 . . . . 0.0 110.683 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.434 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.79 -61.82 1.7 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.894 . . . . 0.0 110.512 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -48.85 -39.6 26.3 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.498 -0.751 . . . . 0.0 111.036 -179.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 ttm -65.34 -45.2 85.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 14.8 tp -59.25 -34.84 72.7 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.362 -0.836 . . . . 0.0 110.714 -179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.434 HG12 ' O ' ' A' ' 53' ' ' ALA . 6.8 mm -61.19 -36.12 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 110.482 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -45.52 93.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.176 -0.953 . . . . 0.0 110.043 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.41 -28.86 46.62 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.287 -0.883 . . . . 0.0 110.463 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.414 ' CD1' ' HA ' ' A' ' 57' ' ' ILE . 86.6 mt -65.82 -54.69 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.39 -0.819 . . . . 0.0 109.841 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -79.35 -30.31 42.59 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.468 -0.77 . . . . 0.0 110.715 -179.645 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -58.96 -25.01 63.16 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.284 -0.885 . . . . 0.0 110.611 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.4 tttt -72.61 -65.29 0.81 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.312 -0.868 . . . . 0.0 110.367 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -160.25 170.12 21.79 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.271 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -75.47 -29.81 59.71 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.371 -0.831 . . . . 0.0 110.128 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -62.84 -33.75 75.89 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.357 -0.839 . . . . 0.0 110.309 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 t -60.2 -26.85 66.69 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.37 -0.831 . . . . 0.0 110.159 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 13.8 t80 -75.86 -37.62 58.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.415 -0.803 . . . . 0.0 110.111 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -70.5 -37.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.895 . . . . 0.0 110.164 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.0 t -69.04 -37.66 78.69 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.324 -0.86 . . . . 0.0 110.279 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 5.8 t80 -54.99 -40.77 70.43 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.266 -0.896 . . . . 0.0 109.879 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.41 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 29.1 t80 -61.71 -38.94 89.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.308 -0.87 . . . . 0.0 109.947 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -78.27 -23.8 47.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.388 -0.82 . . . . 0.0 110.482 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.2 81.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.265 -0.897 . . . . 0.0 110.367 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.415 HD22 ' CD2' ' A' ' 80' ' ' TYR . 32.0 mt -77.78 -37.33 49.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.344 -0.847 . . . . 0.0 110.114 -179.891 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 39.6 mt -65.84 -15.05 62.54 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.453 -0.78 . . . . 0.0 110.467 179.961 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -63.4 -31.85 73.12 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -100.75 -75.68 0.58 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.26 -0.9 . . . . 0.0 110.519 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.26 35.31 0.1 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.415 ' CD2' HD22 ' A' ' 75' ' ' LEU . 18.6 m-85 -94.71 16.01 16.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.445 -1.032 . . . . 0.0 110.484 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 26.9 tttt -47.79 -31.36 4.81 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.342 -0.849 . . . . 0.0 110.677 -179.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.62 -54.47 23.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.405 -0.809 . . . . 0.0 109.807 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 tt -73.22 -41.19 64.02 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.411 -0.806 . . . . 0.0 109.928 179.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.93 82.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.42 -0.8 . . . . 0.0 109.924 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.25 -35.18 76.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.389 -0.82 . . . . 0.0 110.126 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.39 -42.22 91.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.331 -0.856 . . . . 0.0 110.23 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.422 HD21 ' CG ' ' A' ' 12' ' ' HIS . 0.9 OUTLIER -71.41 -42.81 67.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.409 -0.807 . . . . 0.0 110.232 -179.949 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.41 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 21.1 t60 -66.03 -32.92 74.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.385 -0.822 . . . . 0.0 110.305 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.19 -14.84 63.29 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.372 -0.83 . . . . 0.0 110.587 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -108.55 -3.73 32.59 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.498 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 19.3 mt -67.49 -54.98 15.97 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.046 -1.267 . . . . 0.0 110.375 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.498 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo -70.74 -83.15 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 O-C-N 123.319 1.168 . . . . 0.0 110.65 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 58.0 t -128.93 154.81 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.113 -0.992 . . . . 0.0 110.162 179.975 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -111.55 -10.66 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 110.581 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.9 t -56.37 -56.69 18.0 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.2 -0.937 . . . . 0.0 110.37 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.3 t -136.14 -69.64 0.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.345 -0.847 . . . . 0.0 110.282 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.261 179.977 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.172 0.51 . . . . 0.0 110.186 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -115.73 149.08 39.02 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.391 -0.818 . . . . 0.0 110.194 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.86 -24.95 65.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.369 -0.832 . . . . 0.0 110.289 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.3 tttp -64.78 -43.93 91.65 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 110.291 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.63 85.45 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -62.53 -46.32 88.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.331 -0.856 . . . . 0.0 109.747 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -25.48 67.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.775 . . . . 0.0 110.125 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.5 t -58.77 -59.28 5.67 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.4 ' CD1' HG21 ' A' ' 57' ' ' ILE . 0.9 OUTLIER -60.29 -38.49 83.77 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.383 -0.823 . . . . 0.0 109.82 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 28.9 mt -63.24 -29.33 70.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.723 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -99.66 14.74 29.05 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.541 -0.725 . . . . 0.0 110.257 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.418 ' CD2' HD21 ' A' ' 87' ' ' LEU . 60.2 t60 -97.83 25.49 5.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.243 -0.91 . . . . 0.0 110.171 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 ttp-105 -72.31 -50.05 29.89 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.426 -0.796 . . . . 0.0 110.104 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -63.13 -27.05 69.12 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.29 -45.48 12.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.321 -0.862 . . . . 0.0 110.322 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.426 ' CD1' ' C ' ' A' ' 16' ' ' LEU . 2.8 tm? -64.32 -48.4 75.76 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.277 -0.889 . . . . 0.0 109.735 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -64.58 -33.27 75.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.369 -0.832 . . . . 0.0 110.125 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -82.93 -27.32 30.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.344 -0.848 . . . . 0.0 110.123 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 57.2 m-20 -84.2 -63.65 1.3 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -0.831 . . . . 0.0 110.145 179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 27.3 mt -136.11 109.78 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.605 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.564 ' O ' ' C ' ' A' ' 22' ' ' THR . 6.6 mttt -62.15 142.69 57.48 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.353 -0.842 . . . . 0.0 109.241 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.564 ' C ' ' O ' ' A' ' 21' ' ' LYS . 11.7 p -23.62 97.64 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.677 0.751 . . . . 0.0 111.29 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 17.9 t -141.98 -176.28 4.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.665 -0.647 . . . . 0.0 110.316 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 16.4 t80 -33.42 -38.05 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.899 -0.5 . . . . 0.0 111.842 -179.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.439 HD12 HG23 ' A' ' 25' ' ' ILE . 43.3 mm -58.87 -60.17 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.024 -1.047 . . . . 0.0 109.948 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 7.9 mmt -75.35 -28.04 59.43 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.324 -0.86 . . . . 0.0 110.233 179.893 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -74.78 -60.46 2.27 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.324 -0.86 . . . . 0.0 110.51 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -58.35 -25.78 62.38 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.386 -0.821 . . . . 0.0 110.624 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 ttt -70.6 -49.56 46.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.31 -0.869 . . . . 0.0 110.389 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.2 mt -60.01 -31.24 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.304 -0.872 . . . . 0.0 110.152 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 24.7 m -77.91 -14.98 59.36 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.434 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.07 -25.44 45.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.219 -0.926 . . . . 0.0 110.468 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.16 -11.48 3.85 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.429 ' CE1' ' HA ' ' A' ' 67' ' ' SER . 23.1 m-85 -58.43 -58.63 7.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.125 -1.22 . . . . 0.0 110.308 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 5.3 mp -116.04 163.3 16.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.361 -0.837 . . . . 0.0 110.217 -179.879 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -59.74 148.16 35.23 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.378 -0.826 . . . . 0.0 110.41 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 71.9 mt -69.75 -20.6 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.431 -0.793 . . . . 0.0 110.239 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -58.02 -27.35 63.46 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.306 -0.871 . . . . 0.0 110.28 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -67.14 -33.77 76.14 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 110.128 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -59.81 -37.5 79.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.361 -0.837 . . . . 0.0 110.206 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -68.68 -30.22 68.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.347 -0.846 . . . . 0.0 110.101 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -76.42 -57.86 3.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.388 -0.82 . . . . 0.0 110.048 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 66.8 t -48.99 -33.92 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.409 -0.807 . . . . 0.0 110.647 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -48.83 -40.93 31.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.456 -0.777 . . . . 0.0 111.312 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -145.22 18.59 1.56 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.117 -0.989 . . . . 0.0 111.178 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.607 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -81.1 -48.49 1.07 Allowed Pre-proline 0 N--CA 1.493 1.698 0 O-C-N 121.021 -1.049 . . . . 0.0 110.71 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.607 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.7 Cg_endo -77.0 170.15 20.32 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 O-C-N 123.182 1.096 . . . . 0.0 110.291 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -134.16 -46.52 0.77 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.321 -0.862 . . . . 0.0 110.135 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -90.14 -155.34 0.37 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.09 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -76.38 -3.28 36.12 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.254 -0.904 . . . . 0.0 110.674 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -59.91 -17.56 38.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.129 -0.982 . . . . 0.0 110.553 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 69.2 ttt180 -51.55 -43.51 62.38 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.29 -0.881 . . . . 0.0 110.621 -179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.23 -7.69 57.62 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.277 -0.89 . . . . 0.0 110.599 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.02 -45.01 12.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.07 -1.019 . . . . 0.0 110.021 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.0 tpp -76.44 -33.39 58.76 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.38 -0.825 . . . . 0.0 109.912 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.1 tm? -61.17 -44.07 97.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.445 -0.784 . . . . 0.0 109.878 179.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.551 ' N ' ' CD1' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -64.17 -45.89 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.388 -0.82 . . . . 0.0 109.73 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.8 mttp -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.298 -0.876 . . . . 0.0 109.855 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.8 mmt -59.84 -35.37 74.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.301 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 96.7 mt -59.87 -52.77 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.401 -0.812 . . . . 0.0 110.121 179.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.28 -36.23 58.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.334 -0.854 . . . . 0.0 110.705 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -25.5 59.45 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.247 -0.908 . . . . 0.0 110.606 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -84.98 -64.94 1.07 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.87 165.22 34.7 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.266 -0.896 . . . . 0.0 110.226 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -85.13 -22.09 28.99 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.481 -0.762 . . . . 0.0 110.318 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -56.48 -32.79 65.35 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.429 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 21.7 t -73.14 -32.44 64.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.381 -0.824 . . . . 0.0 110.154 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.445 ' CE2' ' CD1' ' A' ' 91' ' ' ILE . 9.3 t80 -63.55 -46.46 85.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.02 -43.91 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.019 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -62.53 -36.37 82.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.363 -0.836 . . . . 0.0 110.111 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 5.9 t80 -53.58 -36.85 62.37 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.327 -0.858 . . . . 0.0 109.693 179.597 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.445 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 28.7 t80 -63.68 -43.27 97.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.436 -0.79 . . . . 0.0 109.827 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -76.56 -27.45 55.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.391 -0.818 . . . . 0.0 110.375 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.66 -51.49 69.15 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.287 -0.883 . . . . 0.0 110.26 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 68.3 mt -65.7 -38.78 90.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.422 -0.799 . . . . 0.0 110.239 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.415 HD12 ' CE1' ' A' ' 72' ' ' TYR . 58.6 mt -67.01 -14.99 63.44 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.347 -0.845 . . . . 0.0 110.482 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -56.94 -25.08 57.05 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.219 -0.925 . . . . 0.0 110.479 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.68 -75.01 0.61 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.314 -0.866 . . . . 0.0 110.375 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.71 60.43 0.15 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -114.36 16.32 17.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -1.04 . . . . 0.0 110.504 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -44.84 -30.05 0.91 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.39 -0.818 . . . . 0.0 110.781 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -67.84 -60.24 2.67 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.319 -0.863 . . . . 0.0 109.732 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.2 tt -69.77 -37.47 76.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.371 -0.831 . . . . 0.0 109.892 179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.09 -29.58 70.42 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.378 -0.826 . . . . 0.0 110.039 179.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.15 71.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.431 -0.793 . . . . 0.0 110.014 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 0.411 ' CD1' ' C ' ' A' ' 86' ' ' LEU . 1.7 tm? -59.16 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.33 -0.857 . . . . 0.0 109.656 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.418 HD21 ' CD2' ' A' ' 12' ' ' HIS . 1.1 mt -72.61 -37.96 67.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.39 -0.819 . . . . 0.0 110.176 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.445 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 21.6 t-160 -60.73 -51.03 71.08 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.407 -0.808 . . . . 0.0 110.258 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.55 -20.01 52.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.325 -0.859 . . . . 0.0 110.326 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.51 2.13 70.13 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.601 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 8.6 mm -76.87 -57.94 1.12 Allowed Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.027 -1.278 . . . . 0.0 110.142 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.601 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.5 Cg_endo -73.74 -82.33 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.256 0 O-C-N 123.207 1.109 . . . . 0.0 110.434 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 59.8 t -147.37 167.68 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.066 -1.021 . . . . 0.0 109.862 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 83.6 t -68.48 -63.43 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.291 -0.881 . . . . 0.0 109.973 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.5 t -159.76 -71.16 0.08 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.4 -0.813 . . . . 0.0 110.142 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.4 m -123.12 -46.89 2.05 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.433 -0.792 . . . . 0.0 110.188 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.196 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.19 0.519 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.52 107.96 1.53 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.342 -0.849 . . . . 0.0 110.192 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.12 -24.58 58.07 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.314 -0.866 . . . . 0.0 110.309 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 ttmm -51.92 -33.61 38.0 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.291 -0.881 . . . . 0.0 110.71 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -67.63 -36.33 80.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.227 -0.92 . . . . 0.0 110.139 -179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 24.1 ttt180 -69.83 -30.34 67.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.399 -0.813 . . . . 0.0 109.969 179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 92.6 m-20 -73.56 -28.92 62.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.394 -0.816 . . . . 0.0 110.172 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -62.56 -51.35 67.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 110.091 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.455 HD22 ' CE1' ' A' ' 68' ' ' TYR . 1.8 tm? -60.36 -34.64 74.15 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.344 -0.847 . . . . 0.0 109.843 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 53.4 mt -62.6 -30.21 71.17 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.357 -0.839 . . . . 0.0 109.958 179.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -91.58 13.16 18.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.365 -0.834 . . . . 0.0 110.457 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.403 ' CD2' ' HB2' ' A' ' 16' ' ' LEU . 42.7 t60 -96.02 22.34 7.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.283 -0.886 . . . . 0.0 110.2 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -75.35 -57.54 3.83 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.259 -0.901 . . . . 0.0 110.452 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.19 -35.12 73.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.375 -0.828 . . . . 0.0 110.49 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.49 -49.7 21.15 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.848 . . . . 0.0 110.166 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.403 ' HB2' ' CD2' ' A' ' 12' ' ' HIS . 7.8 tt -62.09 -32.44 72.99 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.404 -0.81 . . . . 0.0 110.255 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.01 -52.06 65.54 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.425 -0.797 . . . . 0.0 110.384 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -85.07 -25.16 27.75 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.336 -0.853 . . . . 0.0 110.48 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.406 ' HB3' ' CD1' ' A' ' 83' ' ' LEU . 78.9 m-20 -85.35 -65.39 1.02 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.238 -0.914 . . . . 0.0 110.773 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.9 mm -117.09 109.63 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.228 -0.92 . . . . 0.0 110.599 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.0 mttt -96.93 141.68 29.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.461 -0.774 . . . . 0.0 109.156 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.552 ' C ' ' O ' ' A' ' 21' ' ' LYS . 75.8 p -24.39 97.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.681 -0.637 . . . . 0.0 111.202 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 24' ' ' TYR . 41.8 t -156.78 -176.72 6.13 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.603 -0.685 . . . . 0.0 110.357 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.441 ' C ' ' O ' ' A' ' 23' ' ' SER . 14.8 t80 -33.63 -44.5 0.15 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.875 -0.515 . . . . 0.0 111.775 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.57 -52.59 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 120.963 -1.086 . . . . 0.0 109.893 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 6.9 mmt -75.38 -47.13 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.454 -0.779 . . . . 0.0 110.306 179.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.42 -62.17 2.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.421 -0.8 . . . . 0.0 110.793 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -53.01 -36.93 61.04 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.219 -0.926 . . . . 0.0 110.84 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 0.416 ' HG2' ' CE2' ' A' ' 34' ' ' PHE . 20.9 ttp -66.61 -42.82 86.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.278 -0.889 . . . . 0.0 110.342 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 67.5 mt -72.47 -47.31 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.288 -0.882 . . . . 0.0 110.183 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.4 m -63.04 -18.61 63.53 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.283 -0.886 . . . . 0.0 110.48 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.31 -20.04 39.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.193 -0.942 . . . . 0.0 110.535 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.75 -5.05 5.46 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.416 ' CE2' ' HG2' ' A' ' 29' ' ' MET . 7.4 m-30 -55.82 -54.89 39.04 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.136 -1.214 . . . . 0.0 110.395 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.1 mp -129.07 165.11 21.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.365 -0.835 . . . . 0.0 110.077 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.9 p -56.85 145.17 30.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.378 -0.826 . . . . 0.0 110.492 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.4 mt -61.76 -23.89 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.432 -0.792 . . . . 0.0 110.28 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.9 m -59.36 -26.3 64.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.265 -0.897 . . . . 0.0 110.371 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.02 -46.64 83.56 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.273 -0.892 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.06 -32.43 73.8 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.398 -0.814 . . . . 0.0 110.157 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -64.89 -27.53 68.92 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt -84.85 -59.68 2.28 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.389 -0.82 . . . . 0.0 110.33 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 58.4 t -48.14 -33.89 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.432 -0.793 . . . . 0.0 110.758 -179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -47.82 -40.78 22.14 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.409 -0.807 . . . . 0.0 111.14 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.2 18.27 1.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.868 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.594 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.3 tm-20 -81.98 -48.16 0.95 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.108 -0.995 . . . . 0.0 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.594 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.4 Cg_endo -76.05 169.94 21.1 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.186 1.098 . . . . 0.0 110.359 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.5 m -128.6 -40.09 1.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 110.345 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -154.35 0.51 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.15 -12.59 41.31 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.25 -0.906 . . . . 0.0 110.83 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -51.75 -24.52 5.98 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.114 -0.991 . . . . 0.0 110.686 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -55.27 -40.13 70.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.26 -0.9 . . . . 0.0 110.322 -179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.424 ' O ' HD11 ' A' ' 57' ' ' ILE . . . -81.08 -11.54 59.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -0.874 . . . . 0.0 110.469 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.43 -47.76 9.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.988 . . . . 0.0 110.261 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.5 ttt -71.81 -37.85 70.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.84 . . . . 0.0 110.378 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.0 tp -60.36 -46.34 90.29 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.257 -0.902 . . . . 0.0 110.306 -179.902 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.553 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.3 mp -72.51 -39.12 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.837 . . . . 0.0 109.987 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -64.49 -37.29 87.02 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.712 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.36 -31.35 70.24 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 109.939 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 97.1 mt -60.77 -54.74 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.407 -0.808 . . . . 0.0 109.885 179.666 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.4 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 1.7 mm? -69.93 -27.69 64.97 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 110.601 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -67.68 -29.09 68.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.244 -0.91 . . . . 0.0 110.342 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.3 tmtt? -72.74 -64.97 0.85 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.257 -0.902 . . . . 0.0 110.235 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -160.09 166.7 29.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.391 -0.818 . . . . 0.0 110.182 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -81.05 -25.5 37.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.442 -0.786 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -62.27 -34.01 75.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.13 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -59.65 -37.93 80.06 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.376 -0.827 . . . . 0.0 110.012 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.455 ' CE1' HD22 ' A' ' 9' ' ' LEU . 10.4 t80 -66.39 -34.3 77.65 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 109.84 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.6 t -72.69 -40.46 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.0 110.05 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -67.06 -43.45 82.66 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.436 -0.79 . . . . 0.0 110.022 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.435 ' CE1' ' CD1' ' A' ' 75' ' ' LEU . 1.1 t80 -55.15 -29.89 58.72 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.38 -0.825 . . . . 0.0 109.789 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.443 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 26.9 t80 -67.57 -39.64 84.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.355 -0.841 . . . . 0.0 109.939 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -76.51 -34.52 58.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.414 -0.804 . . . . 0.0 110.308 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.8 -31.98 70.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.336 -0.853 . . . . 0.0 110.33 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.435 ' CD1' ' CE1' ' A' ' 71' ' ' PHE . 36.9 mt -82.88 -37.35 24.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.313 -0.867 . . . . 0.0 110.279 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.421 HD13 ' CE1' ' A' ' 72' ' ' TYR . 20.7 mt -70.13 -14.88 62.85 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.388 -0.82 . . . . 0.0 110.477 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -70.49 -23.1 62.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.098 -1.001 . . . . 0.0 110.742 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -106.26 -75.49 0.63 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.21 -0.931 . . . . 0.0 110.559 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.31 35.98 0.1 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 0.405 ' CG ' HD21 ' A' ' 75' ' ' LEU . 48.9 m-85 -100.46 16.04 25.91 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.502 -0.999 . . . . 0.0 110.51 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 45.4 tttt -46.75 -31.78 3.19 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.352 -0.843 . . . . 0.0 110.711 -179.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -67.07 -51.57 52.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.87 . . . . 0.0 109.694 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.406 ' CD1' ' HB3' ' A' ' 19' ' ' ASP . 4.9 tt -71.14 -48.79 49.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 109.99 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.415 ' HB2' ' CD1' ' A' ' 72' ' ' TYR . . . -57.9 -34.92 70.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.417 -0.802 . . . . 0.0 110.312 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -60.75 -36.02 77.85 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.364 -0.835 . . . . 0.0 110.029 -179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 10.0 tt -62.43 -36.5 82.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.422 -0.799 . . . . 0.0 110.288 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.1 mt -80.83 -29.87 35.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.367 -0.833 . . . . 0.0 110.351 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.443 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 57.1 t-80 -75.31 -55.21 5.93 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.393 -0.817 . . . . 0.0 110.494 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.16 -19.13 52.42 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.289 -0.882 . . . . 0.0 110.588 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.86 -22.82 48.2 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.527 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 16.7 mt -56.94 -53.76 61.6 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.269 -1.136 . . . . 0.0 110.684 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.527 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 46.1 Cg_endo -73.09 -53.29 0.13 Allowed 'Trans proline' 0 C--N 1.312 -1.353 0 O-C-N 123.289 1.152 . . . . 0.0 110.735 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 53.5 t -144.93 149.21 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.367 -0.833 . . . . 0.0 110.027 -179.887 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.4 t -53.91 -63.56 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.356 -0.84 . . . . 0.0 110.334 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.2 t -164.31 -71.99 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.36 -0.837 . . . . 0.0 110.288 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.84 -62.78 0.84 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.378 -0.826 . . . . 0.0 110.25 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.243 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.152 0.501 . . . . 0.0 110.102 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -140.8 136.48 32.49 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.359 -0.838 . . . . 0.0 110.36 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.72 -24.45 63.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.376 -0.827 . . . . 0.0 110.116 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -49.44 -37.05 24.34 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.39 -0.819 . . . . 0.0 110.707 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.15 99.34 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.355 -0.84 . . . . 0.0 110.111 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 5.8 ttp85 -65.78 -32.88 74.66 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.348 -0.845 . . . . 0.0 110.126 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -75.4 -25.0 57.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.321 -0.862 . . . . 0.0 110.143 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -62.23 -50.41 71.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.271 -0.893 . . . . 0.0 110.123 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.464 ' CD2' ' CE1' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -64.81 -36.42 84.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 50.8 mt -68.73 -31.61 70.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.428 -0.795 . . . . 0.0 109.909 179.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -96.84 27.7 3.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.415 -0.803 . . . . 0.0 110.01 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.445 ' CG ' HD22 ' A' ' 87' ' ' LEU . 60.5 t60 -112.07 36.57 3.29 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.803 . . . . 0.0 110.079 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 35.7 ttp180 -75.07 -64.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.497 -0.752 . . . . 0.0 110.297 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.83 -27.64 69.02 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.387 -0.821 . . . . 0.0 110.221 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.86 -50.24 74.24 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 110.317 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 0.441 ' HB2' ' CD2' ' A' ' 12' ' ' HIS . 0.7 OUTLIER -75.09 -26.25 59.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 110.533 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.25 -46.06 54.57 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.264 -0.898 . . . . 0.0 110.64 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -85.25 -22.37 28.66 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.421 -0.799 . . . . 0.0 110.531 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 0.417 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . 69.5 m-20 -85.02 -64.99 1.06 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.701 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 0.424 HG23 HD11 ' A' ' 20' ' ' ILE . 43.4 mt -131.4 164.87 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.154 -0.966 . . . . 0.0 111.045 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 0.581 ' O ' ' C ' ' A' ' 22' ' ' THR . 15.6 mmtp -131.84 142.86 49.83 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.581 ' C ' ' O ' ' A' ' 21' ' ' LYS . 71.9 p -23.15 96.03 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 121.641 0.734 . . . . 0.0 110.993 -179.158 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 0.456 ' O ' ' C ' ' A' ' 24' ' ' TYR . 65.2 p -155.84 -175.5 5.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.69 -0.631 . . . . 0.0 110.089 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 0.456 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.8 t80 -32.59 -40.68 0.05 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.751 -0.593 . . . . 0.0 111.805 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 42.5 mm -55.56 -60.5 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.94 -1.1 . . . . 0.0 109.541 179.525 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.53 -34.96 60.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.404 -0.81 . . . . 0.0 110.092 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -67.32 -61.33 1.97 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.392 -0.818 . . . . 0.0 110.375 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -53.02 -24.98 10.86 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.274 -0.891 . . . . 0.0 110.456 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.1 mmt -78.16 -34.37 49.74 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.341 -0.849 . . . . 0.0 110.226 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 73.1 mt -81.96 -43.5 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -66.8 -19.82 65.82 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.36 -0.837 . . . . 0.0 110.485 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.69 -20.29 47.22 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.262 -0.899 . . . . 0.0 110.436 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.96 -6.25 4.75 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 0.403 ' CD2' ' OG ' ' A' ' 67' ' ' SER . 8.7 m-30 -53.68 -58.41 7.3 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.102 -1.234 . . . . 0.0 110.454 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.2 mt -132.03 165.06 24.84 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.303 -0.873 . . . . 0.0 110.292 -179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.4 p -55.48 144.31 26.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.375 -0.828 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.8 mt -74.37 -25.33 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 110.116 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -59.26 -46.1 89.43 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.378 -0.826 . . . . 0.0 110.364 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.72 -32.78 74.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.342 -0.849 . . . . 0.0 110.119 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -63.27 -45.71 90.23 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.816 . . . . 0.0 110.049 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.76 -29.94 60.45 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.375 -0.828 . . . . 0.0 110.114 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 26.0 ttmt -62.86 -54.72 34.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.428 -0.795 . . . . 0.0 109.946 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.2 t -44.7 -33.73 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.572 -0.705 . . . . 0.0 110.557 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -49.24 -33.76 13.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.552 -0.717 . . . . 0.0 111.291 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -145.35 14.09 1.42 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.052 -1.03 . . . . 0.0 111.628 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 0.477 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 4.5 tm-20 -82.05 -48.61 0.92 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 120.878 -1.139 . . . . 0.0 110.959 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.477 ' CD ' ' N ' ' A' ' 46' ' ' GLU . 50.9 Cg_endo -77.97 160.19 30.46 Favored 'Trans proline' 0 C--N 1.314 -1.277 0 O-C-N 123.376 1.198 . . . . 0.0 110.709 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 49.3 m -126.87 -32.24 2.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.49 -0.756 . . . . 0.0 110.282 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.05 -164.07 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.32 -0.863 . . . . 0.0 110.202 179.603 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -19.06 21.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.327 -0.858 . . . . 0.0 110.628 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -52.49 -21.54 3.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.225 -0.922 . . . . 0.0 110.666 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -50.36 -65.27 0.59 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.297 -0.877 . . . . 0.0 110.649 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -66.08 -47.52 74.0 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.385 -0.822 . . . . 0.0 109.913 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -52.17 -33.56 41.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.354 -0.841 . . . . 0.0 110.394 179.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.3 ttt -81.31 -26.49 35.63 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.109 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 5.4 tt -73.05 -50.81 20.84 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.338 -0.851 . . . . 0.0 110.171 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 0.41 ' CG2' ' CD1' ' A' ' 9' ' ' LEU . 3.1 mp -62.56 -37.57 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.399 -0.813 . . . . 0.0 109.913 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -37.35 84.09 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.268 -0.895 . . . . 0.0 109.634 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 28.5 mmm -60.94 -30.18 70.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.825 . . . . 0.0 110.102 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 93.2 mt -62.32 -46.26 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.407 -0.808 . . . . 0.0 109.917 179.72 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -73.52 -28.64 62.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.438 -0.789 . . . . 0.0 110.547 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -40.16 94.63 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.5 tttm -61.38 -65.47 0.69 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.301 -0.874 . . . . 0.0 110.315 -179.722 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.42 170.03 21.83 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.373 -0.829 . . . . 0.0 110.293 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -80.02 -30.12 39.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.383 -0.823 . . . . 0.0 110.142 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -62.38 -27.73 69.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.399 -0.813 . . . . 0.0 110.184 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.403 ' OG ' ' CD2' ' A' ' 34' ' ' PHE . 2.9 t -62.85 -39.47 94.5 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.394 -0.816 . . . . 0.0 110.085 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.464 ' CE1' ' CD2' ' A' ' 9' ' ' LEU . 5.5 t80 -62.08 -39.61 93.01 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.418 -0.801 . . . . 0.0 110.015 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 63.5 t -64.9 -41.77 93.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.316 -0.865 . . . . 0.0 109.964 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 38.4 t -63.06 -37.35 86.85 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.388 -0.82 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.441 ' CZ ' ' CD1' ' A' ' 75' ' ' LEU . 6.5 t80 -54.18 -35.96 62.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.371 -0.83 . . . . 0.0 109.767 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.456 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 28.4 t80 -63.59 -45.82 88.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.419 -0.8 . . . . 0.0 110.078 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -28.45 65.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.256 -0.903 . . . . 0.0 110.296 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.88 -55.64 30.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.3 -0.875 . . . . 0.0 110.419 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 0.441 ' CD1' ' CZ ' ' A' ' 71' ' ' PHE . 11.9 mt -60.72 -35.96 77.63 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.374 -0.829 . . . . 0.0 110.39 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.442 HD13 ' CD1' ' A' ' 72' ' ' TYR . 30.3 mt -71.71 -14.98 62.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.446 -0.784 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -59.71 -33.06 71.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.194 -0.941 . . . . 0.0 110.656 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -105.52 -75.37 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -0.918 . . . . 0.0 110.392 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.95 35.22 0.1 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -95.68 16.32 17.65 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.36 -1.083 . . . . 0.0 110.311 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -45.0 -29.45 0.84 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.412 -0.805 . . . . 0.0 110.863 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.55 -50.17 72.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.269 -0.894 . . . . 0.0 109.757 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.56 -41.79 59.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.38 -0.825 . . . . 0.0 109.587 179.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.84 -32.47 73.69 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 109.999 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.98 -34.61 78.49 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.91 -46.73 87.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.301 -0.874 . . . . 0.0 110.455 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 0.445 HD22 ' CG ' ' A' ' 12' ' ' HIS . 1.8 mp -74.86 -47.41 30.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.336 -0.853 . . . . 0.0 110.332 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 0.456 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 67.8 t60 -59.85 -44.12 94.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.38 -0.825 . . . . 0.0 110.516 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -58.23 -20.64 43.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.329 -0.857 . . . . 0.0 110.534 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -107.08 14.15 40.52 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 0.582 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 7.8 mm -74.08 -57.12 2.42 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.259 . . . . 0.0 109.984 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.582 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo -72.9 -81.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.286 0 O-C-N 123.347 1.182 . . . . 0.0 110.476 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 65.5 t -134.3 162.72 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.183 -0.948 . . . . 0.0 109.94 179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 85.1 t -94.27 -77.15 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.306 -0.871 . . . . 0.0 110.275 -179.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 12.7 t -165.08 -41.62 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.215 -0.928 . . . . 0.0 110.261 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 13.4 p -60.44 -72.88 0.1 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.362 -0.836 . . . . 0.0 110.154 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.2 m . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.241 179.931 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 1.537 ' H2 ' ' CA ' ' A' ' 1' ' ' MET 0.487 0.0 OUTLIER . . . . . 3 N--CA 1.082 -18.859 0 N-CA-C 115.254 1.576 . . . . 3.88 115.254 . . . . . . . . . 4 3 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ASP . . . . . 1.213 ' OD2' ' CB ' ' A' ' 2' ' ' ASP . 3.5 p30 -114.37 129.42 56.65 Favored 'General case' 1 C--N 1.131 -8.921 0 O-C-N 116.508 -3.87 . . . . 1.92 113.191 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 1.015 ' HB3' ' CA ' ' A' ' 3' ' ' ALA . . . -71.19 -27.68 63.68 Favored 'General case' 0 C--N 1.282 -2.33 0 O-C-N 121.434 -0.791 . . . . 1.32 110.335 -179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 1.607 ' HZ2' ' CD ' ' A' ' 4' ' ' LYS . 10.3 tttt -57.31 -37.56 72.67 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.424 -0.797 . . . . 2.59 110.491 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . 1.009 ' HB1' ' CA ' ' A' ' 5' ' ' ALA . . . -62.48 -39.39 93.29 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.155 -0.966 . . . . 1.15 110.154 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ARG . . . . . 1.654 ' HE ' ' CZ ' ' A' ' 6' ' ' ARG . 68.5 ttt180 -66.43 -33.45 75.74 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.29 -0.881 . . . . 3.08 110.11 179.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ASN . . . . . 1.038 ' ND2' ' CB ' ' A' ' 7' ' ' ASN . 3.3 m-20 -72.82 -28.64 62.67 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.395 -0.816 . . . . 1.94 110.182 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 t -61.13 -55.13 36.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.418 -0.801 . . . . 1.11 110.249 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.969 HD21 ' CD2' ' A' ' 9' ' ' LEU . 1.2 tm? -59.24 -36.03 74.74 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.029 -1.044 . . . . 1.15 110.034 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LEU . . . . . 1.034 HD22 ' CG ' ' A' ' 10' ' ' LEU . 66.5 mt -71.01 -28.72 64.62 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.42 -0.8 . . . . 1.32 110.242 179.738 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 1.178 ' NE2' ' CG ' ' A' ' 11' ' ' GLN . 55.1 tt0 -100.15 20.06 15.28 Favored 'General case' 0 C--O 1.171 -3.037 0 CA-C-O 121.526 0.679 . . . . 2.61 110.53 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' HIS . . . . . 0.587 ' NE2' ' CB ' ' A' ' 15' ' ' ALA . 3.6 t-160 -112.83 30.88 6.8 Favored 'General case' 0 C--N 1.262 -3.2 0 O-C-N 120.166 -1.584 . . . . 2.97 111.541 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . 1.594 HH21 ' CZ ' ' A' ' 13' ' ' ARG . 49.2 ttp180 -72.97 -43.92 61.69 Favored 'General case' 0 C--N 1.274 -2.679 0 O-C-N 121.292 -0.88 . . . . 2.84 110.929 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . 1.036 ' OE1' ' CG ' ' A' ' 14' ' ' GLU . 69.6 tt0 -62.25 -33.91 75.51 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.107 -0.995 . . . . 1.31 110.455 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ALA . . . . . 1.007 ' HB3' ' CA ' ' A' ' 15' ' ' ALA . . . -78.43 -42.9 28.73 Favored 'General case' 0 C--O 1.195 -1.798 0 O-C-N 121.231 -0.918 . . . . 1.21 110.59 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' LEU . . . . . 1.576 HD12 ' CG ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.19 -38.93 86.22 Favored 'General case' 0 C--N 1.29 -1.995 0 O-C-N 121.1 -1.0 . . . . 2.16 110.152 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 1.058 ' OE1' ' CG ' ' A' ' 17' ' ' GLU . 60.2 tt0 -60.22 -41.99 94.21 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.466 -0.771 . . . . 1.73 110.638 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . 1.557 ' HZ2' ' CE ' ' A' ' 18' ' ' LYS . 80.3 tttt -78.11 -32.62 50.6 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.173 -0.954 . . . . 2.18 110.575 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . 1.012 ' OD1' ' CB ' ' A' ' 19' ' ' ASP . 65.9 m-20 -82.75 -63.7 1.32 Allowed 'General case' 0 C--N 1.272 -2.768 0 O-C-N 120.337 -1.477 . . . . 1.38 111.564 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ILE . . . . . 1.3 HD12 ' CG1' ' A' ' 20' ' ' ILE . 0.5 OUTLIER -119.39 136.45 56.52 Favored 'Isoleucine or valine' 1 C--O 1.102 -6.689 0 O-C-N 120.73 -1.231 . . . . 1.49 112.225 -179.883 . . . . . . . . 4 4 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . 1.632 ' HE3' ' CD ' ' A' ' 21' ' ' LYS . 88.5 mttt -112.85 141.99 46.03 Favored 'General case' 1 C--N 1.224 -4.851 0 O-C-N 116.772 -3.705 . . . . 2.48 109.125 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . 0.998 HG22 ' CB ' ' A' ' 22' ' ' THR . 75.7 p -24.2 97.41 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.505 0.669 . . . . 1.13 111.212 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' SER . . . . . 1.073 ' CB ' ' OG ' ' A' ' 23' ' ' SER . 0.4 OUTLIER -156.33 -176.21 5.84 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.409 -0.807 . . . . 1.45 110.233 -178.648 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TYR . . . . . 1.392 ' CZ ' ' CD2' ' A' ' 24' ' ' TYR . 12.8 t80 -33.23 -39.82 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.805 -0.559 . . . . 2.17 111.943 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ILE . . . . . 0.996 HD11 ' CG1' ' A' ' 25' ' ' ILE . 44.0 mm -55.74 -62.7 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 120.962 -1.086 . . . . 1.16 110.079 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' MET . . . . . 1.578 ' HE3' ' SD ' ' A' ' 26' ' ' MET . 1.6 mmt -75.54 -38.03 59.59 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.313 -0.867 . . . . 1.65 110.473 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ASP . . . . . 1.044 ' OD1' ' CB ' ' A' ' 27' ' ' ASP . 5.0 t70 -61.03 -53.87 51.87 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 120.89 -1.131 . . . . 1.18 110.705 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' HIS . . . . . 1.472 ' HD2' ' CG ' ' A' ' 28' ' ' HIS . 18.4 t-160 -57.05 -34.22 68.01 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.887 -1.133 . . . . 2.18 110.361 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' MET . . . . . 1.541 ' HE1' ' CG ' ' A' ' 29' ' ' MET . 2.8 mtt -68.51 -41.82 79.44 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 120.943 -1.098 . . . . 3.17 110.411 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ILE . . . . . 1.535 HD12 ' CG1' ' A' ' 30' ' ' ILE . 86.1 mt -64.15 -42.9 97.02 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.169 0 O-C-N 120.91 -1.119 . . . . 1.51 110.382 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.1 m -77.52 -18.81 56.66 Favored 'General case' 0 C--N 1.283 -2.32 0 O-C-N 120.496 -1.377 . . . . 0.93 110.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASP . . . . . 1.097 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 4.9 t70 -58.9 -22.85 60.28 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.087 -1.008 . . . . 1.32 110.453 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.82 -12.49 3.4 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.109 -1.196 . . . . 0.4 110.109 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PHE . . . . . 1.387 ' CZ ' ' CD1' ' A' ' 34' ' ' PHE . 12.7 m-30 -59.42 -61.51 2.57 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.851 -1.382 . . . . 2.2 110.37 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' LEU . . . . . 1.556 HD22 ' CG ' ' A' ' 35' ' ' LEU . 5.6 mp -119.39 162.93 17.98 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.214 -0.929 . . . . 1.95 110.558 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' THR . . . . . 1.056 HG21 ' CB ' ' A' ' 36' ' ' THR . 24.9 p -61.52 157.7 16.6 Favored 'General case' 0 C--O 1.199 -1.603 0 O-C-N 121.201 -0.937 . . . . 1.2 110.344 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . 1.653 HD11 ' CG1' ' A' ' 37' ' ' ILE . 11.3 mt -75.97 -22.36 15.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.2 0 O-C-N 120.807 -1.183 . . . . 1.74 110.459 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 m -59.17 -30.05 67.9 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.308 -0.87 . . . . 0.97 110.456 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -67.07 -31.9 72.71 Favored 'General case' 0 C--N 1.283 -2.308 0 O-C-N 121.176 -0.952 . . . . 1.78 110.712 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 1.163 ' CD ' ' CB ' ' A' ' 40' ' ' GLU . 7.4 tt0 -65.89 -38.8 89.71 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.956 0.884 . . . . 2.32 110.406 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' GLU . . . . . 1.127 ' OE2' ' CG ' ' A' ' 41' ' ' GLU . 32.5 tt0 -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.277 -2.576 0 O-C-N 120.946 -1.096 . . . . 1.75 110.692 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 1.486 ' HZ1' ' CE ' ' A' ' 42' ' ' LYS . 10.5 ttmt -75.99 -56.95 4.18 Favored 'General case' 0 C--N 1.283 -2.311 0 O-C-N 120.903 -1.123 . . . . 2.06 110.407 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.985 HG11 ' CB ' ' A' ' 43' ' ' VAL . 83.0 t -50.12 -33.78 9.99 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.495 -0.753 . . . . 1.2 110.638 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -47.38 -40.4 17.53 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.564 -0.71 . . . . 3.28 111.613 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 1.202 ' OD1' ' CB ' ' A' ' 45' ' ' ASN . 2.4 t30 -143.72 16.59 1.8 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.026 -1.046 . . . . 1.96 111.225 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . 1.273 ' CD ' ' CB ' ' A' ' 46' ' ' GLU . 1.4 tt0 -80.24 -50.88 1.11 Allowed Pre-proline 0 C--N 1.299 -1.606 0 O-C-N 120.867 -1.145 . . . . 2.52 110.893 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.625 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.4 Cg_endo -75.81 168.81 23.52 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 O-C-N 123.127 1.067 . . . . 0.58 110.465 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' THR . . . . . 1.104 ' HG1' ' CB ' ' A' ' 48' ' ' THR . 19.5 m -135.94 -42.21 0.66 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.47 -0.769 . . . . 1.33 110.517 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 1.514 ' NE2' ' CG ' ' A' ' 49' ' ' GLN . 12.6 mm-40 -95.37 -159.05 0.69 Allowed 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.915 -1.116 . . . . 2.43 110.063 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 1.612 ' HG2' ' CB ' ' A' ' 50' ' ' GLN . 5.4 mp0 -65.74 -12.69 55.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.26 -0.9 . . . . 2.73 110.952 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' GLN . . . . . 1.041 ' OE1' ' CG ' ' A' ' 51' ' ' GLN . 56.5 tt0 -56.36 -20.2 18.11 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.288 -0.882 . . . . 1.77 110.75 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 1.445 ' CD ' ' CZ ' ' A' ' 52' ' ' ARG . 45.5 ttt180 -51.44 -48.9 62.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.174 -0.954 . . . . 2.75 110.752 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ALA . . . . . 0.987 ' HB1' ' CB ' ' A' ' 53' ' ' ALA . . . -77.3 -34.8 55.41 Favored 'General case' 1 C--O 1.147 -4.314 0 O-C-N 120.679 -1.263 . . . . 1.16 110.318 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.42 ' CB ' ' HD2' ' A' ' 13' ' ' ARG . . . -63.15 -36.75 84.64 Favored 'General case' 1 C--N 1.241 -4.11 0 O-C-N 118.042 -2.911 . . . . 0.99 110.666 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' MET . . . . . 1.734 ' HE3' ' SD ' ' A' ' 55' ' ' MET . 11.8 ttt -78.26 -34.54 48.97 Favored 'General case' 0 C--N 1.293 -1.858 0 O-C-N 121.194 -0.941 . . . . 2.27 110.246 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . 1.469 HD13 ' CG ' ' A' ' 56' ' ' LEU . 13.3 tp -69.16 -41.58 77.06 Favored 'General case' 0 C--N 1.287 -2.152 0 O-C-N 120.616 -1.303 . . . . 1.51 110.441 -179.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . 1.443 HD11 ' CG1' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -65.62 -37.37 79.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 O-C-N 121.1 -1.0 . . . . 1.29 110.174 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 1.582 ' HE3' ' CD ' ' A' ' 58' ' ' LYS . 12.7 mttt -66.8 -39.91 87.93 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.044 -1.035 . . . . 2.03 110.017 179.756 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' MET . . . . . 1.531 ' HE2' ' SD ' ' A' ' 59' ' ' MET . 5.6 mmt -58.62 -31.18 67.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.882 . . . . 1.91 110.229 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ILE . . . . . 0.998 HG22 ' CG2' ' A' ' 60' ' ' ILE . 98.6 mt -63.59 -53.96 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.303 -0.873 . . . . 1.1 109.938 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.97 HD12 ' CG ' ' A' ' 61' ' ' LEU . 2.0 mm? -75.24 -32.46 61.12 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.405 -0.809 . . . . 1.12 110.672 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 1.515 ' HE3' ' CD ' ' A' ' 62' ' ' LYS . 16.9 mmtt -61.19 -27.9 68.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.15 -0.969 . . . . 2.24 110.567 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 1.532 ' CG ' ' CE ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -73.43 -65.0 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.233 -0.917 . . . . 3.03 110.363 -179.917 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 1.18 ' OD2' ' CB ' ' A' ' 64' ' ' ASP . 13.4 t0 -159.73 165.34 32.72 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.345 -0.847 . . . . 1.75 110.211 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . 0.997 ' ND2' ' CB ' ' A' ' 65' ' ' ASN . 2.7 m-20 -80.07 -26.4 39.66 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.287 -0.883 . . . . 1.66 110.32 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASP . . . . . 0.997 ' OD2' ' CB ' ' A' ' 66' ' ' ASP . 12.4 m-20 -61.43 -35.36 77.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.876 . . . . 1.24 110.347 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.4 t -62.59 -34.57 77.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.274 -0.891 . . . . 0.92 110.162 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 1.395 ' CZ ' ' CD2' ' A' ' 68' ' ' TYR . 19.3 t80 -64.33 -38.53 91.37 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.211 -0.931 . . . . 2.18 110.068 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . 0.976 HG13 ' CB ' ' A' ' 69' ' ' VAL . 59.7 t -68.0 -39.32 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.281 -0.887 . . . . 1.11 110.052 179.809 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' SER . . . . . 1.136 ' HG ' ' CB ' ' A' ' 70' ' ' SER . 34.6 t -66.78 -36.53 82.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.23 -0.919 . . . . 0.9 110.054 179.883 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 1.426 ' CZ ' ' CD1' ' A' ' 71' ' ' PHE . 1.2 t80 -55.43 -37.43 67.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.288 -0.882 . . . . 2.18 109.886 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 1.367 ' CG ' ' CE2' ' A' ' 72' ' ' TYR . 44.8 t80 -64.41 -43.85 93.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 2.14 110.104 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASN . . . . . 1.011 ' ND2' ' CB ' ' A' ' 73' ' ' ASN . 8.9 t30 -75.44 -26.73 58.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.271 -0.893 . . . . 1.64 110.463 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.03 94.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.93 . . . . 1.0 110.338 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' LEU . . . . . 1.015 HD11 ' CG ' ' A' ' 75' ' ' LEU . 16.8 mt -75.26 -38.44 60.47 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.949 -1.095 . . . . 1.13 110.274 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.992 HD22 ' CG ' ' A' ' 76' ' ' LEU . 29.9 mt -67.25 -15.13 63.52 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.405 -0.809 . . . . 1.14 110.554 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' HIS . . . . . 1.532 ' HD2' ' CG ' ' A' ' 77' ' ' HIS . 3.5 t-80 -62.32 -24.7 67.47 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 2.18 110.751 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . 1.447 ' OE1' ' CG ' ' A' ' 78' ' ' GLU . 28.0 mt-10 -109.74 -75.21 0.63 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.172 -0.955 . . . . 1.59 110.414 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.89 47.77 0.15 Allowed Glycine 0 C--O 1.187 -2.791 0 N-CA-C 109.438 -1.465 . . . . 0.55 109.438 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' TYR . . . . . 1.409 ' CG ' ' CE2' ' A' ' 80' ' ' TYR . 34.6 m-85 -106.16 16.22 25.23 Favored 'General case' 0 C--N 1.276 -2.599 0 O-C-N 120.029 -1.865 . . . . 2.3 110.534 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 1.564 ' HZ1' ' CE ' ' A' ' 81' ' ' LYS . 46.6 tttt -44.88 -31.59 1.3 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.424 -0.797 . . . . 2.13 110.953 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . 1.005 ' OD1' ' CB ' ' A' ' 82' ' ' ASP . 2.7 m-20 -68.34 -51.98 38.38 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 1.26 109.9 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 1.627 HD22 ' CG ' ' A' ' 83' ' ' LEU . 0.0 OUTLIER -72.12 -44.12 63.65 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.048 -1.033 . . . . 2.1 110.174 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . 0.985 ' HB2' ' CA ' ' A' ' 84' ' ' ALA . . . -60.02 -35.06 74.25 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.405 -0.81 . . . . 1.21 110.228 179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ALA . . . . . 0.982 ' HB3' ' CA ' ' A' ' 85' ' ' ALA . . . -62.43 -36.0 81.02 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.306 -0.871 . . . . 1.12 110.169 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' LEU . . . . . 1.606 HD22 ' CG ' ' A' ' 86' ' ' LEU . 9.1 tp -60.31 -43.54 96.25 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.35 -0.844 . . . . 2.13 110.368 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' LEU . . . . . 1.002 HD23 ' CG ' ' A' ' 87' ' ' LEU . 0.9 OUTLIER -75.29 -35.44 61.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.208 -0.933 . . . . 1.22 110.25 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' HIS . . . . . 1.535 ' HD2' ' CG ' ' A' ' 88' ' ' HIS . 22.7 t-80 -68.97 -39.25 79.57 Favored 'General case' 0 C--O 1.187 -2.226 0 O-C-N 120.93 -1.106 . . . . 2.15 110.559 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ASP . . . . . 0.981 ' OD1' ' CB ' ' A' ' 89' ' ' ASP . 53.4 m-20 -69.67 -18.87 63.6 Favored 'General case' 0 C--N 1.278 -2.542 0 O-C-N 120.165 -1.585 . . . . 1.32 110.908 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.63 -14.78 52.21 Favored Glycine 0 C--O 1.189 -2.681 0 C-N-CA 119.709 -1.234 . . . . 0.68 110.363 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' ILE . . . . . 1.41 HD12 ' CG1' ' A' ' 91' ' ' ILE . 33.9 mt -64.75 -54.33 36.72 Favored Pre-proline 0 C--N 1.286 -2.188 0 O-C-N 120.488 -1.596 . . . . 1.35 110.452 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' PRO . . . . . 0.557 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.7 Cg_endo -71.91 -77.32 0.01 OUTLIER 'Trans proline' 0 C--O 1.178 -2.525 0 O-C-N 123.158 1.083 . . . . 0.86 110.762 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' VAL . . . . . 1.213 HG22 ' CB ' ' A' ' 93' ' ' VAL 0.268 58.9 t -131.26 156.36 42.64 Favored 'Isoleucine or valine' 2 C--O 1.075 -8.098 0 CA-C-O 115.84 -2.029 . . . . 2.23 114.69 179.903 . . . . . . . . 4 3 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' VAL . . . . . 1.503 HG21 ' CB ' ' A' ' 94' ' ' VAL 0.311 59.8 t -96.38 -44.59 12.87 Favored 'Isoleucine or valine' 3 C--O 0.971 -13.573 0 CA-C-N 121.248 1.84 . . . . 2.47 114.471 -179.953 . . . . . . . . 4 3 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 1.515 ' HA ' ' CB ' ' A' ' 95' ' ' SER 0.79 48.4 t -100.96 -46.52 5.07 Favored 'General case' 4 C--O 0.734 -26.04 2 CA-C-O 147.325 12.964 . . . . 4.46 139.397 -179.958 . . . . . . . . 5 3 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' SER . . . . . 1.635 ' CA ' ' HG ' ' A' ' 97' ' ' SER 1.005 21.2 t -95.88 -11.97 25.91 Favored 'General case' 4 C--N 0.49 -36.797 3 O-C-N 96.876 -16.14 . . . . 4.41 87.062 -179.896 . . . . . . . . 5 3 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' SER . . . . . 1.635 ' HG ' ' CA ' ' A' ' 96' ' ' SER 1.351 4.7 m . . . . . 4 C--O 0.283 -49.812 3 CA-C-O 154.849 16.547 . . . . 6.32 123.543 179.93 . . . . . . . . 4 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.166 0.507 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -59.16 -35.71 74.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 110.516 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.552 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -56.06 -40.78 74.08 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.096 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.734 ' O ' HD12 ' A' ' 10' ' ' LEU . 4.0 ttp180 -62.29 -32.49 73.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.37 -0.831 . . . . 0.0 109.653 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -77.88 -25.14 48.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.924 179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 t -59.75 -54.19 49.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.935 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.958 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -62.47 -36.92 84.0 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.406 -0.809 . . . . 0.0 109.614 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.734 HD12 ' O ' ' A' ' 6' ' ' ARG . 12.3 mt -67.93 -35.3 78.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 109.54 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -90.79 2.64 55.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.42 -0.8 . . . . 0.0 110.122 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -92.59 19.04 7.78 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.302 -0.874 . . . . 0.0 110.224 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -69.21 -44.29 72.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 110.138 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.48 -32.61 74.32 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.395 -0.815 . . . . 0.0 110.169 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.28 -42.31 55.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.326 -0.859 . . . . 0.0 110.169 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HG ' ' HB ' ' A' ' 20' ' ' ILE . 5.2 tt -75.93 -37.42 58.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.426 -0.796 . . . . 0.0 110.244 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -53.53 -41.44 66.38 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.406 -0.809 . . . . 0.0 110.469 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -85.46 -34.32 21.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.512 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.22 -65.53 1.0 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.256 -0.903 . . . . 0.0 110.782 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.477 ' HB ' ' HG ' ' A' ' 16' ' ' LEU . 11.0 mm -108.44 111.13 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.295 -0.878 . . . . 0.0 110.647 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.565 ' O ' ' C ' ' A' ' 22' ' ' THR . 4.3 mtpt -97.06 141.75 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.598 -0.689 . . . . 0.0 109.349 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 21' ' ' LYS . 69.5 p -24.44 97.4 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 CA-C-O 121.455 0.645 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 27.5 t -157.36 -176.8 6.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.556 -0.715 . . . . 0.0 110.154 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 15.9 t80 -33.54 -41.58 0.09 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.773 -0.58 . . . . 0.0 111.788 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.44 HG13 HD12 ' A' ' 20' ' ' ILE . 44.0 mm -59.38 -50.01 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.053 -1.03 . . . . 0.0 110.007 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.571 ' HE1' HD11 ' A' ' 60' ' ' ILE . 0.6 OUTLIER -75.65 -37.49 59.62 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.339 -0.851 . . . . 0.0 110.439 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -72.35 -57.56 4.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.255 -0.903 . . . . 0.0 110.605 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -51.7 -25.22 6.87 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.313 -0.867 . . . . 0.0 110.579 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.6 -57.07 3.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.308 -0.87 . . . . 0.0 110.174 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.669 HG23 ' HB2' ' A' ' 35' ' ' LEU . 83.9 mt -57.12 -47.33 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.271 -0.893 . . . . 0.0 109.937 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 75.0 m -66.27 -15.15 62.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.377 -0.827 . . . . 0.0 110.36 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -59.67 -28.91 67.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.284 -0.885 . . . . 0.0 110.395 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.32 -18.11 1.33 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.186 -1.166 . . . . 0.0 110.186 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -54.5 -60.7 2.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.122 -1.222 . . . . 0.0 110.315 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.669 ' HB2' HG23 ' A' ' 30' ' ' ILE . 1.1 mt -121.66 162.97 19.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.417 -0.802 . . . . 0.0 110.265 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.8 p -60.72 147.73 41.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.343 -0.848 . . . . 0.0 110.401 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 88.8 mt -71.37 -17.84 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.398 -0.814 . . . . 0.0 110.242 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 m -58.82 -27.88 65.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.326 -0.859 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.469 ' O ' HG23 ' A' ' 43' ' ' VAL . 23.0 tt0 -68.43 -26.51 65.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.4 -0.813 . . . . 0.0 110.159 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -63.32 -49.14 75.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.361 -0.837 . . . . 0.0 110.192 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -60.75 -27.97 68.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 110.182 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -77.92 -58.58 3.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 110.064 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.695 HG11 HD13 ' A' ' 56' ' ' LEU . 65.9 t -50.91 -33.4 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.408 -0.808 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.6 ttp85 -50.8 -42.86 58.55 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.256 -0.903 . . . . 0.0 111.34 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -134.27 8.95 3.73 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.029 -1.044 . . . . 0.0 111.455 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.584 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.0 tp10 -73.96 -53.6 3.96 Favored Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.033 -1.042 . . . . 0.0 110.186 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -74.41 170.29 20.57 Favored 'Trans proline' 0 C--N 1.313 -1.325 0 O-C-N 123.388 1.204 . . . . 0.0 110.269 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.3 m -135.84 -38.23 0.72 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.391 -0.818 . . . . 0.0 110.436 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -104.25 -157.46 0.61 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.849 . . . . 0.0 110.262 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -58.09 -19.83 35.1 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.344 -0.847 . . . . 0.0 110.55 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.475 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 7.4 tt0 -52.84 -23.82 7.77 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.238 -0.913 . . . . 0.0 110.56 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG2' HG21 ' A' ' 22' ' ' THR . 21.1 ttp180 -52.98 -53.14 54.31 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.265 -0.897 . . . . 0.0 110.319 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.517 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -80.67 -8.65 59.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.86 . . . . 0.0 110.412 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.475 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -83.85 -36.01 23.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.1 -1.0 . . . . 0.0 110.054 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.4 tpp -81.21 -27.4 35.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.353 -0.842 . . . . 0.0 110.162 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.695 HD13 HG11 ' A' ' 43' ' ' VAL . 14.3 tp -68.87 -38.22 79.57 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.364 -0.835 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.572 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.1 mp -74.15 -45.76 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.317 -0.864 . . . . 0.0 109.825 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -60.64 -38.44 84.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.256 -0.902 . . . . 0.0 109.675 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.4 mmt -56.55 -36.06 68.84 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.386 -0.821 . . . . 0.0 110.113 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.571 HD11 ' HE1' ' A' ' 26' ' ' MET . 79.1 mt -58.02 -52.47 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.322 -0.861 . . . . 0.0 109.916 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.467 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.5 mm? -77.37 -29.43 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.412 -0.805 . . . . 0.0 110.706 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -58.58 -25.89 63.04 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.183 -0.948 . . . . 0.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.8 tptm -83.68 -65.57 0.99 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.908 . . . . 0.0 110.271 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -160.54 170.19 21.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.374 -0.829 . . . . 0.0 110.297 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -84.16 -20.11 32.98 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.421 -0.799 . . . . 0.0 110.271 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -60.41 -43.04 97.11 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.25 -0.906 . . . . 0.0 110.294 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.1 t -61.32 -32.48 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.41 -0.806 . . . . 0.0 110.309 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.958 ' CE1' HD23 ' A' ' 9' ' ' LEU . 6.4 t80 -64.1 -37.18 86.51 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.384 -0.823 . . . . 0.0 110.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.07 -31.82 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.37 -0.831 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.0 t -69.88 -43.57 71.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.294 -0.879 . . . . 0.0 110.019 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.666 ' CE1' HD11 ' A' ' 75' ' ' LEU . 1.1 t80 -53.93 -35.69 61.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.334 -0.854 . . . . 0.0 109.612 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.473 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 25.2 t80 -63.74 -38.5 91.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.499 -0.75 . . . . 0.0 109.858 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -82.96 -25.52 32.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.405 -0.809 . . . . 0.0 110.158 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.43 80.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.666 HD11 ' CE1' ' A' ' 71' ' ' PHE . 45.1 mt -78.36 -40.08 37.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.42 -0.8 . . . . 0.0 110.151 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.43 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.5 mt -65.68 -15.5 62.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.359 -0.838 . . . . 0.0 110.397 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -65.36 -26.32 67.97 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.224 -0.922 . . . . 0.0 110.58 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -108.01 -75.16 0.64 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.922 . . . . 0.0 110.595 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.0 62.93 0.11 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -124.93 16.25 8.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.435 -1.039 . . . . 0.0 110.478 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -46.32 -29.21 1.56 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.376 -0.827 . . . . 0.0 111.031 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.13 -65.05 0.75 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.301 -0.875 . . . . 0.0 110.077 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 87' ' ' LEU . 8.5 tt -66.77 -39.8 87.99 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.45 -39.26 60.86 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.278 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.16 90.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.791 . . . . 0.0 109.902 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.6 tt -52.52 -46.4 66.67 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.4 -0.812 . . . . 0.0 110.568 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.3 mp -73.06 -48.5 35.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.358 -0.839 . . . . 0.0 110.288 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.614 ' HA ' HD12 ' A' ' 91' ' ' ILE . 78.1 t60 -65.37 -16.09 63.25 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.388 -0.82 . . . . 0.0 110.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -85.02 -14.77 46.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.191 -0.943 . . . . 0.0 110.747 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -111.33 -22.86 5.97 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.624 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 54.7 mt -60.59 -52.06 75.39 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.154 -1.204 . . . . 0.0 110.822 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.624 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.6 Cg_endo . . . . . 0 C--N 1.315 -1.23 0 O-C-N 123.221 1.116 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.171 0.51 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -63.35 -32.43 73.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.263 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.32 95.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.382 -0.824 . . . . 0.0 110.071 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.641 ' HG3' HD12 ' A' ' 61' ' ' LEU . 28.5 ttt180 -65.62 -29.66 70.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.367 -0.833 . . . . 0.0 110.126 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.42 ' HA ' HD12 ' A' ' 10' ' ' LEU . 28.1 m120 -74.08 -31.73 62.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.4 -0.813 . . . . 0.0 110.142 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 47.1 t -60.63 -51.9 67.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.4 -0.812 . . . . 0.0 110.294 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.821 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER -61.98 -35.26 77.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.368 -0.832 . . . . 0.0 110.057 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 7' ' ' ASN . 67.4 mt -63.14 -34.36 77.44 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.278 -0.889 . . . . 0.0 109.89 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -97.02 24.98 5.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.391 -0.818 . . . . 0.0 110.066 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -94.81 20.02 9.33 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.336 -0.853 . . . . 0.0 110.451 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 70.4 ttp85 -69.29 -56.94 6.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.308 -0.87 . . . . 0.0 110.114 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -65.14 -35.27 80.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.289 -0.882 . . . . 0.0 110.101 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.0 -46.24 65.55 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.371 -0.831 . . . . 0.0 110.298 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.474 HD22 HG13 ' A' ' 57' ' ' ILE . 1.2 tp -59.35 -39.95 84.85 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.38 -41.64 66.09 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.403 -0.811 . . . . 0.0 110.265 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -85.06 -23.22 28.65 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.391 -0.818 . . . . 0.0 110.152 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.99 -65.25 1.03 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.256 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.768 HD13 HG13 ' A' ' 25' ' ' ILE . 14.8 mt -147.24 158.38 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.335 -0.853 . . . . 0.0 110.52 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.577 ' O ' ' C ' ' A' ' 22' ' ' THR . 5.6 mttt -114.34 141.91 47.0 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 21' ' ' LYS . 58.9 p -24.23 98.75 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 CA-C-O 121.516 0.674 . . . . 0.0 110.999 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.8 t -152.06 -176.22 5.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.568 -0.707 . . . . 0.0 110.308 -178.658 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.9 t80 -32.87 -38.94 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.866 -0.521 . . . . 0.0 112.224 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.768 HG13 HD13 ' A' ' 20' ' ' ILE . 43.9 mm -55.89 -66.31 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 120.954 -1.091 . . . . 0.0 110.175 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.545 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 13.9 mmm -76.53 -35.93 58.0 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.36 -0.837 . . . . 0.0 110.259 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.681 ' HA ' HD12 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -60.14 -52.68 64.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.432 -0.792 . . . . 0.0 110.458 -179.752 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -58.49 -29.7 66.44 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.304 -0.872 . . . . 0.0 110.248 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.5 mtt -69.8 -42.5 73.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.271 -0.893 . . . . 0.0 110.294 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 27' ' ' ASP . 59.2 mt -55.16 -50.24 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.258 -0.901 . . . . 0.0 110.196 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.1 m -74.34 -14.97 60.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.409 -0.807 . . . . 0.0 110.301 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.28 -31.2 65.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.268 -0.895 . . . . 0.0 110.45 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 147.47 -20.03 1.51 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.972 -1.251 . . . . 0.0 109.972 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -57.15 -51.65 68.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.163 -1.198 . . . . 0.0 110.203 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mp -132.12 155.48 48.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.367 -0.833 . . . . 0.0 110.115 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.4 p -57.48 160.22 4.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.414 -0.804 . . . . 0.0 110.324 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.2 mt -71.19 -15.31 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.372 -0.83 . . . . 0.0 110.322 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.3 m -56.18 -26.17 49.64 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.276 -0.89 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -66.55 -34.03 77.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.321 -0.862 . . . . 0.0 110.219 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -68.46 -37.11 79.9 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.315 -0.865 . . . . 0.0 110.174 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.21 -33.82 76.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.428 -0.795 . . . . 0.0 110.1 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -75.99 -60.56 2.27 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.354 -0.841 . . . . 0.0 110.1 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.513 HG21 HD12 ' A' ' 56' ' ' LEU . 80.4 t -48.53 -33.6 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.491 -0.755 . . . . 0.0 110.546 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -43.8 -48.71 8.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.643 -0.661 . . . . 0.0 111.403 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -145.26 14.36 1.45 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.118 -0.989 . . . . 0.0 111.235 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.631 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.1 tp10 -80.17 -47.84 1.33 Allowed Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.032 -1.042 . . . . 0.0 110.962 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -75.99 170.25 20.49 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.154 1.081 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.7 m -145.86 -45.41 0.21 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.362 -0.836 . . . . 0.0 110.289 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -91.51 -166.87 1.66 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.378 -0.826 . . . . 0.0 110.305 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -17.78 45.29 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.359 -0.838 . . . . 0.0 110.498 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -57.04 -18.89 15.88 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.253 -0.905 . . . . 0.0 110.556 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -49.53 -60.86 2.47 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.353 -0.842 . . . . 0.0 110.579 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.536 ' HB2' HG23 ' A' ' 22' ' ' THR . . . -74.14 -52.57 12.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.152 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.97 -34.21 5.35 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.385 -0.822 . . . . 0.0 110.622 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.6 ttp -82.95 -25.56 32.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.513 HD12 HG21 ' A' ' 43' ' ' VAL . 6.6 tt -81.45 -35.69 30.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.345 -0.847 . . . . 0.0 110.342 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.545 ' CD1' ' HE3' ' A' ' 26' ' ' MET . 41.7 mm -64.21 -43.15 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.244 -0.91 . . . . 0.0 109.934 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -61.06 -41.1 95.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.345 -0.847 . . . . 0.0 109.915 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.1 mtp -56.23 -33.33 65.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.303 -0.873 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.471 HD12 ' HA ' ' A' ' 57' ' ' ILE . 91.6 mt -61.19 -53.72 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.241 -0.912 . . . . 0.0 109.985 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.641 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.0 mm? -76.76 -30.22 56.45 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.473 -0.767 . . . . 0.0 110.506 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -26.62 66.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.302 -0.874 . . . . 0.0 110.221 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -64.99 1.03 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.356 -0.84 . . . . 0.0 110.166 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -159.93 155.74 26.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.401 -0.812 . . . . 0.0 110.219 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -77.23 -23.9 51.3 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.357 -0.84 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.08 -29.65 68.72 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.377 -0.827 . . . . 0.0 110.283 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 12.2 t -68.93 -34.91 76.14 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.304 -0.873 . . . . 0.0 110.053 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.821 ' CE1' HD23 ' A' ' 9' ' ' LEU . 19.9 t80 -62.45 -34.6 77.13 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.452 -0.78 . . . . 0.0 110.01 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.89 -40.85 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.41 -0.807 . . . . 0.0 110.033 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -69.42 -34.69 74.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.306 -0.871 . . . . 0.0 110.086 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.598 ' CE1' HD11 ' A' ' 75' ' ' LEU . 32.6 t80 -53.14 -35.48 59.78 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.054 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.882 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 47.6 t80 -70.68 -44.6 66.69 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.333 -0.854 . . . . 0.0 110.198 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -73.26 -27.88 61.82 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.37 -0.831 . . . . 0.0 110.479 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -48.9 65.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.294 -0.879 . . . . 0.0 110.384 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.604 HD13 HD12 ' A' ' 83' ' ' LEU . 14.9 mt -66.46 -44.61 82.31 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.333 -0.855 . . . . 0.0 110.351 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.632 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 35.1 mt -65.32 -15.03 62.11 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 110.544 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -63.33 -24.46 67.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.204 -0.935 . . . . 0.0 110.632 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -112.03 -75.24 0.61 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.206 -0.933 . . . . 0.0 110.543 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -170.8 66.19 0.15 Allowed Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.582 ' CE1' HD11 ' A' ' 20' ' ' ILE . 20.0 m-85 -125.09 16.37 8.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -1.039 . . . . 0.0 110.481 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -43.14 -31.3 0.56 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.914 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.6 -42.08 59.31 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.387 -0.82 . . . . 0.0 109.779 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -73.24 -44.57 59.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.48 -0.763 . . . . 0.0 109.848 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.882 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.34 -33.55 73.81 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.391 -0.818 . . . . 0.0 110.043 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.42 -36.44 82.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 110.113 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.12 -56.96 15.26 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.421 -0.8 . . . . 0.0 110.23 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.24 -35.69 76.39 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.906 . . . . 0.0 110.072 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.698 ' HA ' HD12 ' A' ' 91' ' ' ILE . 49.1 t60 -62.15 -37.57 85.71 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -65.96 -17.56 64.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.426 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -102.57 -2.11 50.1 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.698 HD12 ' HA ' ' A' ' 88' ' ' HIS . 18.5 mt -72.04 -55.48 5.14 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.278 . . . . 0.0 110.34 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.562 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.1 Cg_endo . . . . . 0 C--N 1.313 -1.337 0 O-C-N 123.265 1.139 . . . . 0.0 110.54 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.127 0.489 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -56.19 -39.5 72.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.32 -0.863 . . . . 0.0 110.458 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.414 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -62.09 -36.98 83.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.287 -0.883 . . . . 0.0 110.188 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.505 ' HG3' HD12 ' A' ' 61' ' ' LEU . 42.6 ttp180 -72.01 -44.09 63.99 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.89 -25.21 67.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.296 -0.877 . . . . 0.0 110.238 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.75 -57.59 10.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.338 -0.851 . . . . 0.0 110.141 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.731 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.8 OUTLIER -56.4 -34.75 67.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.315 -0.866 . . . . 0.0 110.131 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 90.9 mt -80.6 -20.34 43.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.35 -0.844 . . . . 0.0 110.429 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -110.53 31.49 5.92 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -0.856 . . . . 0.0 110.381 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.448 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 4.5 t-160 -142.41 45.0 1.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.351 -0.843 . . . . 0.0 109.987 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -75.09 -37.31 61.59 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.442 -0.786 . . . . 0.0 110.507 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.43 -35.47 65.44 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.175 -0.953 . . . . 0.0 110.595 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.448 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -85.59 -56.3 3.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.288 -0.882 . . . . 0.0 110.312 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.74 HD23 HG13 ' A' ' 57' ' ' ILE . 56.7 tp -55.85 -42.64 76.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.343 -0.848 . . . . 0.0 110.59 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -60.51 -49.29 78.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 0.0 110.079 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -72.19 -26.35 62.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.364 -0.835 . . . . 0.0 110.04 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -72.41 -58.65 3.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.85 . . . . 0.0 110.09 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.723 HD13 HG21 ' A' ' 25' ' ' ILE . 22.8 mt -135.59 109.86 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.366 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.567 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.8 mttt -79.45 142.67 35.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.556 -0.715 . . . . 0.0 109.558 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.567 ' C ' ' O ' ' A' ' 21' ' ' LYS . 61.6 p -23.75 97.34 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 CA-C-O 121.454 0.645 . . . . 0.0 111.09 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 24' ' ' TYR . 32.7 t -152.87 -176.52 5.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.712 -0.617 . . . . 0.0 110.222 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.446 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.7 t80 -33.0 -44.5 0.11 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.826 -0.546 . . . . 0.0 111.957 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.723 HG21 HD13 ' A' ' 20' ' ' ILE . 43.0 mm -54.74 -63.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.075 -1.016 . . . . 0.0 110.195 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.515 ' CE ' HD11 ' A' ' 16' ' ' LEU . 15.1 mtt -75.37 -39.03 59.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -59.79 -51.47 69.59 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.367 -0.833 . . . . 0.0 110.565 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -54.47 -36.1 63.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.268 -0.895 . . . . 0.0 110.337 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -32.19 73.5 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -0.825 . . . . 0.0 110.079 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.634 HD13 HD13 ' A' ' 35' ' ' LEU . 47.2 mm -60.78 -65.13 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.295 -0.878 . . . . 0.0 110.062 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -68.67 -18.62 64.31 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.395 -0.816 . . . . 0.0 110.551 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -24.44 25.89 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.184 -0.947 . . . . 0.0 110.374 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 -13.94 4.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.497 ' CB ' HD12 ' A' ' 35' ' ' LEU . 25.0 m-85 -69.62 -55.24 10.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -1.187 . . . . 0.0 110.454 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.634 HD13 HD13 ' A' ' 30' ' ' ILE . 4.6 mp -121.83 165.17 16.29 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.326 -0.859 . . . . 0.0 110.416 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.0 p -65.16 147.68 53.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 110.24 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.1 mt -73.14 -20.85 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.412 -0.805 . . . . 0.0 110.219 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 m -57.91 -36.79 72.95 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.228 -0.92 . . . . 0.0 110.356 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.453 ' O ' HG23 ' A' ' 43' ' ' VAL . 35.2 tt0 -63.61 -26.84 68.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.368 -0.833 . . . . 0.0 110.212 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -68.69 -45.31 72.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.327 -0.858 . . . . 0.0 110.136 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -63.13 -36.42 83.55 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.316 -0.865 . . . . 0.0 110.152 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -58.24 3.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.423 -0.798 . . . . 0.0 110.179 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 39' ' ' GLU . 68.9 t -50.83 -33.55 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.384 -0.823 . . . . 0.0 110.346 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -46.06 -32.4 2.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.509 -0.744 . . . . 0.0 111.468 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -145.42 21.7 1.51 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.01 -1.057 . . . . 0.0 111.309 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.442 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 0.3 OUTLIER -85.87 -54.53 0.41 Allowed Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.091 -1.006 . . . . 0.0 110.767 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 46' ' ' GLU . 49.9 Cg_endo -77.22 163.87 29.84 Favored 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.456 1.24 . . . . 0.0 110.614 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.9 m -137.4 -42.96 0.55 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.348 -0.845 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.26 -161.25 0.57 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.056 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -15.07 56.17 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.299 -0.875 . . . . 0.0 110.636 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 52.6 tt0 -55.98 -20.16 15.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.193 -0.942 . . . . 0.0 110.664 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.489 ' HG2' HG21 ' A' ' 22' ' ' THR . 25.7 ttm180 -51.45 -54.82 23.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.168 -0.958 . . . . 0.0 110.606 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.36 -29.2 34.15 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.331 -0.856 . . . . 0.0 110.188 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.59 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -62.45 -32.16 72.99 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.257 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 4.9 ttt -80.63 -48.16 13.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.427 -0.795 . . . . 0.0 110.31 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 26' ' ' MET . 23.4 tp -58.68 -36.36 74.07 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.379 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.74 HG13 HD23 ' A' ' 16' ' ' LEU . 0.2 OUTLIER -61.6 -44.47 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.434 -0.791 . . . . 0.0 109.672 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -70.28 -36.77 74.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.47 -0.769 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.404 ' O ' HD21 ' A' ' 35' ' ' LEU . 21.4 mmt -59.52 -36.53 76.3 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.339 -0.851 . . . . 0.0 110.367 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 57' ' ' ILE . 77.0 mt -60.67 -58.56 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.452 -0.78 . . . . 0.0 110.239 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.505 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.43 -40.28 77.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.572 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -59.08 -31.17 68.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.302 -0.874 . . . . 0.0 110.411 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -65.09 0.73 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.319 -0.863 . . . . 0.0 110.183 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -160.16 158.62 30.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.288 -0.882 . . . . 0.0 110.213 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -81.84 -26.86 33.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.456 -0.777 . . . . 0.0 110.194 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.52 -34.25 77.38 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.294 -0.879 . . . . 0.0 110.261 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.3 t -65.15 -36.89 85.65 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.353 -0.842 . . . . 0.0 110.155 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.625 ' HE1' HD23 ' A' ' 9' ' ' LEU . 18.9 t80 -59.25 -36.62 75.82 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.39 -0.819 . . . . 0.0 110.105 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.75 -46.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.361 -0.837 . . . . 0.0 109.986 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.5 t -62.02 -33.97 75.34 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.304 -0.873 . . . . 0.0 109.999 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.796 ' CE1' HD11 ' A' ' 75' ' ' LEU . 3.3 t80 -57.74 -36.67 72.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.35 -0.844 . . . . 0.0 109.787 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 34.6 t80 -62.74 -41.86 99.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.496 -0.752 . . . . 0.0 109.941 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.81 -27.35 40.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.4 -0.813 . . . . 0.0 110.225 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.37 -47.79 84.56 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.325 -0.86 . . . . 0.0 110.192 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.796 HD11 ' CE1' ' A' ' 71' ' ' PHE . 7.8 mt -66.78 -41.17 88.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.328 -0.857 . . . . 0.0 110.224 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.423 HD21 ' HB3' ' A' ' 84' ' ' ALA . 43.6 mt -66.68 -15.11 63.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.421 -0.799 . . . . 0.0 110.57 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -61.96 -22.41 65.62 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.191 -0.943 . . . . 0.0 110.549 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -112.53 -75.15 0.61 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.22 -0.925 . . . . 0.0 110.426 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.97 36.9 0.11 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -93.78 16.44 14.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.458 -1.025 . . . . 0.0 110.49 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -42.19 -31.33 0.37 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.522 -0.736 . . . . 0.0 110.906 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -67.52 -48.1 68.01 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.356 -0.84 . . . . 0.0 109.703 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.659 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -78.09 -44.02 27.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.508 -0.745 . . . . 0.0 109.827 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.423 ' HB3' HD21 ' A' ' 76' ' ' LEU . . . -59.15 -43.47 92.06 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.349 -0.844 . . . . 0.0 110.238 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.03 -29.72 70.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.35 -0.844 . . . . 0.0 110.11 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.7 tp -57.43 -46.09 83.93 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.355 -0.841 . . . . 0.0 110.309 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mp -73.97 -33.42 63.86 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.856 ' HA ' HD12 ' A' ' 91' ' ' ILE . 13.3 t-160 -58.91 -25.77 63.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.348 -0.845 . . . . 0.0 110.386 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -85.04 -18.85 33.09 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.335 -0.853 . . . . 0.0 110.451 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -97.08 -26.98 9.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.856 HD12 ' HA ' ' A' ' 88' ' ' HIS . 42.9 mt -56.87 -47.88 98.3 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.352 -1.087 . . . . 0.0 110.977 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo . . . . . 0 C--N 1.315 -1.225 0 O-C-N 123.223 1.117 . . . . 0.0 110.72 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.112 0.482 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -29.35 61.14 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.329 -0.857 . . . . 0.0 110.575 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.69 -38.04 88.84 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.235 -0.915 . . . . 0.0 110.223 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -68.1 -28.51 67.4 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.206 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -79.44 -27.21 41.68 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.351 -0.843 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.62 -51.0 70.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.474 -0.766 . . . . 0.0 110.165 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.731 ' O ' HD13 ' A' ' 9' ' ' LEU . 3.0 tm? -62.53 -36.77 83.64 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.369 -0.832 . . . . 0.0 109.752 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.47 -27.53 62.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.319 -0.863 . . . . 0.0 110.137 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -98.07 27.47 4.55 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.285 -0.884 . . . . 0.0 110.121 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.725 ' ND1' ' HB3' ' A' ' 15' ' ' ALA . 1.9 t-80 -124.22 26.92 7.27 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.468 -0.77 . . . . 0.0 109.9 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -75.68 -36.58 60.03 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.286 -0.884 . . . . 0.0 110.475 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -68.36 -36.0 78.55 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.295 -0.878 . . . . 0.0 110.617 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.725 ' HB3' ' ND1' ' A' ' 12' ' ' HIS . . . -85.05 -30.28 24.24 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.361 -0.837 . . . . 0.0 110.027 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.405 ' CD2' ' CG1' ' A' ' 57' ' ' ILE . 1.3 tp -80.72 -44.03 19.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.395 -0.815 . . . . 0.0 110.032 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -59.16 -35.66 73.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.385 -0.822 . . . . 0.0 110.071 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -78.2 -41.78 33.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.38 -0.825 . . . . 0.0 110.285 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.24 -65.28 1.03 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.241 -0.912 . . . . 0.0 110.514 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.645 HD12 HG21 ' A' ' 25' ' ' ILE . 12.8 mm -94.95 109.69 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.544 ' O ' ' C ' ' A' ' 22' ' ' THR . 2.7 mtpm? -103.28 141.3 36.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.59 -0.694 . . . . 0.0 109.284 179.15 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.692 HG21 ' HD3' ' A' ' 52' ' ' ARG . 73.4 p -24.68 98.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.677 -0.64 . . . . 0.0 110.987 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.438 ' O ' ' C ' ' A' ' 24' ' ' TYR . 81.4 p -159.97 -176.58 5.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.559 -0.713 . . . . 0.0 110.377 -178.628 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.438 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.7 t80 -33.55 -39.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.86 -0.525 . . . . 0.0 111.939 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.645 HG21 HD12 ' A' ' 20' ' ' ILE . 44.8 mm -57.23 -65.69 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.029 -1.044 . . . . 0.0 109.997 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.437 ' SD ' HD11 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -76.11 -40.87 51.94 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 110.189 179.711 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -55.02 -60.02 3.95 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.363 -0.835 . . . . 0.0 110.717 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -56.73 -38.82 72.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.35 -0.844 . . . . 0.0 110.457 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.557 ' HE3' HG23 ' A' ' 60' ' ' ILE . 4.5 ttp -62.99 -28.11 69.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.377 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.557 HG23 ' HB2' ' A' ' 35' ' ' LEU . 27.2 mt -83.85 -34.55 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.259 -0.9 . . . . 0.0 110.29 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -87.26 -18.73 29.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.294 -0.879 . . . . 0.0 110.512 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -57.58 -23.7 52.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.238 -0.914 . . . . 0.0 110.38 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 141.23 -17.13 2.72 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.821 -1.311 . . . . 0.0 109.821 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.64 ' C ' HD22 ' A' ' 35' ' ' LEU . 7.1 m-30 -53.84 -66.6 0.36 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.237 -1.154 . . . . 0.0 110.333 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.64 HD22 ' C ' ' A' ' 34' ' ' PHE . 4.0 mm? -106.44 165.15 11.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.488 -0.757 . . . . 0.0 110.058 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.3 p -59.59 169.34 1.34 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.432 -0.792 . . . . 0.0 110.273 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.8 mt -84.68 -24.45 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.384 -0.823 . . . . 0.0 110.158 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.4 m -58.91 -24.53 62.47 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.348 -0.845 . . . . 0.0 110.365 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -60.67 -35.88 77.35 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.31 -0.869 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.45 -36.34 80.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.75 -27.04 63.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.341 -0.849 . . . . 0.0 110.096 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 ttmt -82.95 -61.75 1.78 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.378 -0.826 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 61.7 t -48.05 -33.75 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.585 -0.697 . . . . 0.0 110.838 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttm-85 -45.98 -47.22 16.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.486 -0.759 . . . . 0.0 111.279 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -144.99 23.82 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.147 -0.971 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.611 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 1.1 tm-20 -81.82 -48.91 0.95 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.863 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.2 Cg_endo -75.99 169.88 21.23 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.127 1.067 . . . . 0.0 110.526 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.4 m -136.69 -41.97 0.61 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.404 -0.81 . . . . 0.0 110.139 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -100.2 -152.88 0.43 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.009 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.21 -7.65 48.23 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.222 -0.924 . . . . 0.0 110.66 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -55.72 -21.28 17.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.108 -0.995 . . . . 0.0 110.663 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.692 ' HD3' HG21 ' A' ' 22' ' ' THR . 20.3 ttm180 -52.76 -32.46 43.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.25 -0.906 . . . . 0.0 110.557 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.491 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -91.57 -11.67 36.6 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.299 -0.876 . . . . 0.0 110.524 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.65 -42.76 14.02 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.077 -1.014 . . . . 0.0 110.244 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -43.02 24.17 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.312 -0.867 . . . . 0.0 110.219 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.506 HD22 HG22 ' A' ' 22' ' ' THR . 18.2 tp -60.15 -38.73 84.02 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.245 -0.91 . . . . 0.0 110.125 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.573 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.2 mp -76.51 -34.33 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.368 -0.833 . . . . 0.0 109.684 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -68.06 -38.11 82.06 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.323 -0.861 . . . . 0.0 109.641 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 mtt -59.88 -35.02 73.95 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.029 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.557 HG23 ' HE3' ' A' ' 29' ' ' MET . 95.8 mt -58.27 -52.33 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.396 -0.815 . . . . 0.0 110.036 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -75.18 -22.19 58.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.39 -0.819 . . . . 0.0 110.763 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.51 -27.36 63.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.252 -0.905 . . . . 0.0 110.585 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HB2' HD11 ' A' ' 35' ' ' LEU . 47.5 tptt -70.8 -65.17 0.77 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.263 -0.898 . . . . 0.0 110.208 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -160.11 155.51 25.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.404 -0.81 . . . . 0.0 110.275 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.8 -28.19 65.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.464 -0.773 . . . . 0.0 110.125 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -62.41 -37.1 84.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.465 -0.772 . . . . 0.0 110.213 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.1 t -60.93 -33.22 72.82 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.294 -0.879 . . . . 0.0 110.174 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.64 ' HE1' HD23 ' A' ' 9' ' ' LEU . 15.6 t80 -64.86 -39.93 94.34 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.464 -0.772 . . . . 0.0 110.118 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.45 -31.79 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.335 -0.853 . . . . 0.0 110.074 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.6 t -70.61 -38.93 74.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.353 -0.842 . . . . 0.0 109.984 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.575 ' CE2' HD22 ' A' ' 87' ' ' LEU . 5.0 t80 -54.82 -38.19 67.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.385 -0.822 . . . . 0.0 109.818 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.703 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.0 t80 -65.08 -46.87 79.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.377 -0.827 . . . . 0.0 109.941 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.446 ' HA ' HD12 ' A' ' 76' ' ' LEU . 4.0 t30 -72.02 -25.95 62.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.369 -0.832 . . . . 0.0 110.42 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.32 -45.03 74.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 110.178 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.544 HD11 ' CE1' ' A' ' 71' ' ' PHE . 28.5 mt -68.56 -38.17 80.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.325 -0.859 . . . . 0.0 110.353 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.703 HD11 ' CE1' ' A' ' 72' ' ' TYR . 22.6 mt -66.38 -15.17 63.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.349 -0.844 . . . . 0.0 110.576 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -63.04 -22.81 67.11 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.214 -0.929 . . . . 0.0 110.549 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.49 -75.46 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.212 -0.93 . . . . 0.0 110.407 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.2 35.94 0.1 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -95.28 16.2 17.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.995 . . . . 0.0 110.449 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 11.9 ttpt -46.48 -30.58 2.26 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.392 -0.817 . . . . 0.0 110.973 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -62.09 -60.92 2.9 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.285 -0.884 . . . . 0.0 109.821 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 83' ' ' LEU . 5.5 tt -71.28 -43.8 66.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.442 -0.786 . . . . 0.0 109.992 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.27 -40.53 71.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.444 -0.785 . . . . 0.0 110.305 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.57 -35.17 75.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.599 HD23 ' CE1' ' A' ' 12' ' ' HIS . 19.3 tp -61.69 -28.24 69.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.369 -0.832 . . . . 0.0 110.271 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 71' ' ' PHE . 0.6 OUTLIER -84.62 -39.52 18.58 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.31 -0.869 . . . . 0.0 110.429 -179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.846 ' HA ' HD12 ' A' ' 91' ' ' ILE . 48.5 t-80 -67.36 -47.8 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -69.59 -15.07 63.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.349 -0.844 . . . . 0.0 110.562 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -91.37 -16.38 53.23 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 88' ' ' HIS . 18.7 mt -66.54 -53.77 27.56 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.159 -1.201 . . . . 0.0 110.436 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.576 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo . . . . . 0 C--N 1.313 -1.331 0 O-C-N 123.336 1.177 . . . . 0.0 110.706 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.155 0.502 . . . . 0.0 110.272 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -58.17 -50.46 73.46 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.317 -0.865 . . . . 0.0 110.269 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.708 ' CB ' HG23 ' A' ' 91' ' ' ILE . . . -61.21 -35.65 77.77 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.286 -0.884 . . . . 0.0 109.786 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HG3' HD12 ' A' ' 61' ' ' LEU . 23.0 ttm-85 -68.42 -36.01 78.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.393 -0.817 . . . . 0.0 109.79 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -65.5 -32.86 74.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.473 -0.767 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.4 t -57.57 -59.83 4.58 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.312 -0.868 . . . . 0.0 110.082 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.938 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.4 tm? -59.33 -34.85 72.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.349 -0.844 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.5 mt -73.62 -28.0 61.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.367 -0.833 . . . . 0.0 110.054 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -93.66 1.98 56.45 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.42 -0.8 . . . . 0.0 110.567 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.439 ' ND1' ' HB3' ' A' ' 15' ' ' ALA . 43.5 t-80 -98.15 28.99 3.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.155 -0.966 . . . . 0.0 109.696 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -71.01 -55.25 8.68 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.304 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.41 -34.58 75.6 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.439 ' HB3' ' ND1' ' A' ' 12' ' ' HIS . . . -74.2 -34.72 63.81 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.293 -0.879 . . . . 0.0 110.133 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.66 HD13 HG13 ' A' ' 57' ' ' ILE . 8.3 tt -77.16 -40.81 44.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.464 -0.773 . . . . 0.0 110.39 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.8 -41.88 62.04 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.28 -0.888 . . . . 0.0 110.405 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.6 ttpt -85.5 -32.0 22.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.343 -0.848 . . . . 0.0 110.548 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.627 ' HB3' HD11 ' A' ' 83' ' ' LEU . 70.6 m-20 -85.18 -65.53 1.0 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.879 . . . . 0.0 111.01 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 25' ' ' ILE . 13.4 mm -114.58 122.33 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.23 -0.919 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.553 ' O ' ' C ' ' A' ' 22' ' ' THR . 19.2 mtmm -113.75 141.89 46.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.631 -0.668 . . . . 0.0 109.23 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.809 HG22 HD22 ' A' ' 56' ' ' LEU . 74.0 p -24.1 97.53 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.652 -0.655 . . . . 0.0 111.149 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 24' ' ' TYR . 34.9 t -160.63 -176.75 5.74 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.487 -0.758 . . . . 0.0 110.557 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 23' ' ' SER . 8.1 t80 -33.57 -46.67 0.2 Allowed 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.899 -0.501 . . . . 0.0 112.168 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.473 HG21 HD12 ' A' ' 20' ' ' ILE . 38.6 mm -49.91 -64.67 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.06 -1.025 . . . . 0.0 110.527 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.586 ' HE2' HD11 ' A' ' 16' ' ' LEU . 4.5 mmt -72.75 -53.5 11.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.345 -0.847 . . . . 0.0 110.367 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -46.64 -43.92 17.93 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.51 -0.744 . . . . 0.0 111.067 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 58.0 t60 -59.64 -37.35 78.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.119 -0.988 . . . . 0.0 109.846 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 29.9 mmt -80.26 -28.23 38.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.419 -0.801 . . . . 0.0 110.199 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.711 HG21 ' OE1' ' A' ' 40' ' ' GLU . 29.4 mm -64.41 -50.45 76.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.351 -0.843 . . . . 0.0 109.937 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.0 m -75.71 -19.74 58.87 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.348 -0.845 . . . . 0.0 110.483 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -24.07 47.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.164 -0.96 . . . . 0.0 110.358 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.47 -17.52 2.06 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.637 ' C ' HD22 ' A' ' 35' ' ' LEU . 12.6 m-30 -56.23 -72.33 0.08 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.217 -1.166 . . . . 0.0 110.451 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.637 HD22 ' C ' ' A' ' 34' ' ' PHE . 4.0 mm? -106.47 161.82 14.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.293 -0.879 . . . . 0.0 110.227 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 p -70.67 162.5 28.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.403 -0.811 . . . . 0.0 110.095 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.0 mt -79.25 -29.13 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.287 -0.883 . . . . 0.0 110.06 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -61.97 -33.16 73.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.405 -0.809 . . . . 0.0 110.171 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.711 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.5 tt0 -75.02 -26.74 59.71 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 110.316 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.711 ' OE1' HG21 ' A' ' 30' ' ' ILE . 9.1 tp10 -74.0 -39.02 63.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.288 -0.882 . . . . 0.0 110.313 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -62.13 -35.93 80.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.296 -0.878 . . . . 0.0 110.261 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.401 ' O ' ' N ' ' A' ' 46' ' ' GLU . 16.0 tttt -72.29 -41.89 66.14 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.201 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.711 HG23 ' O ' ' A' ' 39' ' ' GLU . 98.9 t -58.26 -34.47 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.344 -0.848 . . . . 0.0 110.38 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -55.87 -24.78 38.98 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.333 -0.854 . . . . 0.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -142.69 15.4 1.96 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.128 -0.982 . . . . 0.0 111.073 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.629 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 34.1 tt0 -81.85 -51.19 0.83 Allowed Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.017 -1.052 . . . . 0.0 110.585 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.629 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -76.61 170.2 20.37 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.201 1.106 . . . . 0.0 110.404 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.3 m -124.71 -39.04 2.32 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.36 -0.837 . . . . 0.0 110.274 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -104.31 -153.48 0.48 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.307 -0.871 . . . . 0.0 110.053 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -8.73 51.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.211 -0.931 . . . . 0.0 110.656 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -52.06 -24.97 7.56 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.114 -0.991 . . . . 0.0 110.65 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HG2' HG21 ' A' ' 22' ' ' THR . 24.2 ttp180 -52.95 -25.26 11.37 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.246 -0.909 . . . . 0.0 110.544 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.445 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -86.96 -26.32 23.89 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.309 -0.87 . . . . 0.0 110.315 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.82 -29.41 50.64 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 110.373 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.3 ttt -79.16 -52.47 8.13 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.304 -0.872 . . . . 0.0 110.481 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.809 HD22 HG22 ' A' ' 22' ' ' THR . 32.1 tp -51.08 -35.06 33.03 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.375 -0.828 . . . . 0.0 110.95 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.705 ' HA ' HD12 ' A' ' 60' ' ' ILE . 0.8 OUTLIER -72.78 -32.19 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.219 -0.926 . . . . 0.0 110.265 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -70.87 -35.63 72.47 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 110.348 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.467 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -65.04 -29.49 70.39 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.229 -0.919 . . . . 0.0 110.141 179.672 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.705 HD12 ' HA ' ' A' ' 57' ' ' ILE . 96.6 mt -62.74 -53.55 45.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.886 . . . . 0.0 109.684 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.571 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.1 mm? -73.67 -37.22 65.34 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt -60.34 -27.55 67.45 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.336 -0.853 . . . . 0.0 110.524 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -78.67 -64.66 1.12 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.154 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -160.2 153.89 22.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.351 -0.843 . . . . 0.0 110.207 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -74.96 -24.13 58.41 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.32 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -36.82 83.0 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.313 -0.867 . . . . 0.0 110.114 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.8 t -61.66 -31.47 71.59 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.468 -0.77 . . . . 0.0 110.061 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.938 ' CE1' HD23 ' A' ' 9' ' ' LEU . 8.7 t80 -68.2 -38.53 82.06 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.323 -0.861 . . . . 0.0 110.008 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.7 -42.54 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.345 -0.847 . . . . 0.0 110.105 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.8 t -62.96 -39.13 93.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.88 . . . . 0.0 109.938 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.72 ' CE2' HD11 ' A' ' 75' ' ' LEU . 1.8 t80 -53.25 -36.62 61.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.469 -0.77 . . . . 0.0 109.824 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.687 ' CE1' HD11 ' A' ' 76' ' ' LEU . 31.3 t80 -63.53 -45.91 88.39 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.308 -0.87 . . . . 0.0 110.075 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 0.459 ' HA ' HD12 ' A' ' 76' ' ' LEU . 5.5 t30 -75.98 -23.07 55.28 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.308 -0.87 . . . . 0.0 110.583 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.11 -33.99 75.53 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.176 -0.952 . . . . 0.0 110.403 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.72 HD11 ' CE2' ' A' ' 71' ' ' PHE . 4.3 mt -84.79 -33.69 22.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.34 -0.85 . . . . 0.0 110.432 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.708 HD21 ' CB ' ' A' ' 84' ' ' ALA . 26.6 mt -67.65 -14.93 63.37 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.375 -0.828 . . . . 0.0 110.584 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -66.51 -24.45 66.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.158 -0.964 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -103.26 -75.1 0.62 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.219 -0.926 . . . . 0.0 110.504 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.85 48.3 0.15 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -106.27 16.16 25.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.435 -1.038 . . . . 0.0 110.495 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -46.14 -32.74 3.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.387 -0.82 . . . . 0.0 110.735 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -68.63 -63.59 1.03 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 109.856 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.724 HD23 ' O ' ' A' ' 83' ' ' LEU . 4.7 tt -62.79 -36.43 83.11 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.89 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.708 ' CB ' HD21 ' A' ' 76' ' ' LEU . . . -59.95 -36.69 77.62 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.469 -0.769 . . . . 0.0 110.044 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.23 -34.27 74.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.455 -0.778 . . . . 0.0 110.07 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.89 -47.48 84.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.451 -0.781 . . . . 0.0 109.926 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.41 ' O ' HD12 ' A' ' 91' ' ' ILE . 0.9 OUTLIER -72.1 -39.96 68.53 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.36 -0.838 . . . . 0.0 110.174 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.653 ' HA ' HD12 ' A' ' 91' ' ' ILE . 27.5 t-80 -62.42 -55.54 26.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.38 -0.825 . . . . 0.0 110.173 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.5 -24.78 61.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.806 . . . . 0.0 110.302 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -75.04 -14.44 81.81 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.708 HG23 ' CB ' ' A' ' 5' ' ' ALA . 7.9 mt -72.84 -57.64 3.02 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.211 -1.17 . . . . 0.0 110.328 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.591 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 47.1 Cg_endo . . . . . 0 C--N 1.314 -1.274 0 O-C-N 123.29 1.153 . . . . 0.0 110.467 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.716 0 CA-C-O 121.127 0.489 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -59.44 -37.44 78.12 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.399 -0.813 . . . . 0.0 110.212 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.21 -38.21 79.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.276 -0.89 . . . . 0.0 109.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.658 ' HG3' HD12 ' A' ' 61' ' ' LEU . 47.2 ttt180 -64.64 -31.93 73.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.381 -0.824 . . . . 0.0 109.778 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -75.68 -27.79 58.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.431 -0.793 . . . . 0.0 110.028 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.9 t -61.83 -60.44 3.64 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.319 -0.863 . . . . 0.0 110.168 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.748 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.8 OUTLIER -53.33 -34.89 59.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.359 -0.838 . . . . 0.0 110.105 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 48.9 mt -79.97 -26.22 40.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.355 -0.84 . . . . 0.0 110.273 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -110.15 33.25 4.56 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.407 -0.808 . . . . 0.0 110.337 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.439 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.6 t-160 -146.39 43.54 1.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.331 -0.855 . . . . 0.0 110.081 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.3 ttp85 -75.36 -31.5 60.55 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.443 -0.786 . . . . 0.0 110.297 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.07 -34.43 70.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.225 -0.922 . . . . 0.0 110.402 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.439 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -84.93 -42.43 14.98 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.094 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.703 HD22 HG12 ' A' ' 57' ' ' ILE . 9.2 tt -63.1 -37.37 86.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.385 -0.822 . . . . 0.0 110.19 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -76.09 -32.07 59.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.79 . . . . 0.0 110.073 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -64.78 -49.66 69.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.43 -0.794 . . . . 0.0 110.128 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -84.55 -55.72 3.98 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.381 -0.825 . . . . 0.0 110.066 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.655 HG21 ' CE ' ' A' ' 26' ' ' MET . 14.9 mm -98.95 158.19 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.292 -0.88 . . . . 0.0 109.995 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.561 ' O ' ' C ' ' A' ' 22' ' ' THR . 50.9 mttt -154.14 141.52 19.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.477 -0.765 . . . . 0.0 109.481 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.931 HG22 HD22 ' A' ' 56' ' ' LEU . 67.9 p -24.63 96.5 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 121.47 0.652 . . . . 0.0 110.893 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 42.7 m -163.36 -175.84 4.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.548 -0.72 . . . . 0.0 110.157 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 11.2 t80 -33.08 -37.26 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.894 -0.504 . . . . 0.0 112.092 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.607 HG13 HD12 ' A' ' 20' ' ' ILE . 46.2 mm -54.63 -65.78 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.047 -1.033 . . . . 0.0 109.994 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.655 ' CE ' HG21 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -76.43 -34.47 58.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.349 -0.844 . . . . 0.0 110.374 179.544 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -57.32 -41.88 80.8 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.364 -0.835 . . . . 0.0 110.553 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -75.01 -50.37 16.76 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.308 -0.87 . . . . 0.0 110.37 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 mpp? -60.02 -50.33 74.14 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.338 -0.851 . . . . 0.0 110.437 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.908 HG23 ' HB2' ' A' ' 35' ' ' LEU . 98.6 mt -61.35 -28.66 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.459 -0.776 . . . . 0.0 110.297 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.0 m -90.32 -23.0 21.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.353 -0.842 . . . . 0.0 110.354 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -59.72 -21.48 60.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.332 -0.855 . . . . 0.0 110.421 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.24 -16.59 2.1 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.656 ' C ' HD22 ' A' ' 35' ' ' LEU . 7.4 m-30 -53.15 -71.56 0.07 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.147 -1.208 . . . . 0.0 110.247 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.908 ' HB2' HG23 ' A' ' 30' ' ' ILE . 4.0 mm? -108.12 164.12 12.57 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 109.908 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 p -62.53 144.33 56.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.376 -0.827 . . . . 0.0 110.197 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.554 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.5 mp -69.53 -22.97 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.24 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -57.02 -27.88 62.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.297 -0.877 . . . . 0.0 110.316 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -62.34 -37.46 85.72 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.38 -0.825 . . . . 0.0 110.077 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.55 -33.11 72.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.412 -0.805 . . . . 0.0 110.201 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -69.0 -31.13 69.73 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.316 -0.865 . . . . 0.0 110.229 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HG2' ' CB ' ' A' ' 46' ' ' GLU . 1.6 ttmt -84.87 -59.47 2.34 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 110.377 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.442 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 88.7 t -48.5 -33.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.501 -0.749 . . . . 0.0 110.786 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -44.97 -45.43 10.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.554 -0.716 . . . . 0.0 111.421 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -144.49 15.2 1.62 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.092 -1.005 . . . . 0.0 111.125 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.623 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 3.0 tm-20 -79.94 -48.09 1.38 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.116 -0.99 . . . . 0.0 110.891 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.623 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -75.49 166.78 27.94 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.121 1.063 . . . . 0.0 110.522 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.3 m -136.44 -42.93 0.62 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.438 -0.789 . . . . 0.0 110.174 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -96.2 -159.23 0.71 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.35 -0.844 . . . . 0.0 110.129 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -64.06 -14.58 55.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.313 -0.867 . . . . 0.0 110.641 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -55.96 -19.96 14.39 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.271 -0.893 . . . . 0.0 110.721 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -49.69 -49.68 46.7 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.342 -0.849 . . . . 0.0 110.496 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.27 -42.98 53.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.396 -0.815 . . . . 0.0 110.323 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.43 -34.06 4.41 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.254 -0.904 . . . . 0.0 110.801 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 19.0 ttt -85.03 -24.75 28.05 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.306 -0.872 . . . . 0.0 110.019 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.931 HD22 HG22 ' A' ' 22' ' ' THR . 4.8 tp -82.01 -46.85 13.39 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.374 -0.828 . . . . 0.0 110.72 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.703 HG12 HD22 ' A' ' 16' ' ' LEU . 1.9 mp -68.63 -32.4 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.272 -0.893 . . . . 0.0 110.242 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp -71.04 -39.45 72.29 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.238 -0.914 . . . . 0.0 110.062 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.0 mmt -58.89 -29.24 66.87 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.355 -0.84 . . . . 0.0 110.338 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 57' ' ' ILE . 92.9 mt -67.08 -59.9 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.368 -0.833 . . . . 0.0 110.078 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.658 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.25 -38.75 78.61 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.447 -0.783 . . . . 0.0 110.483 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -59.87 -25.37 65.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.323 -0.861 . . . . 0.0 110.387 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.57 ' HB2' HD11 ' A' ' 35' ' ' LEU . 5.9 tptp -73.54 -65.43 0.82 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.44 169.95 21.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 110.376 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -83.9 -26.09 29.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.769 . . . . 0.0 110.14 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.01 -40.78 98.8 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.369 -0.832 . . . . 0.0 110.008 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.4 t -60.06 -33.28 71.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.29 -0.881 . . . . 0.0 110.12 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.618 ' HE1' HD23 ' A' ' 9' ' ' LEU . 26.7 t80 -65.73 -40.96 92.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.39 -0.819 . . . . 0.0 109.892 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.2 -41.38 83.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.387 -0.821 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.2 t -64.11 -32.7 74.36 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.351 -0.843 . . . . 0.0 110.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.645 ' CE1' HD11 ' A' ' 75' ' ' LEU . 7.8 t80 -57.97 -42.19 84.52 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.4 -0.813 . . . . 0.0 109.89 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.827 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 36.3 t80 -62.6 -37.95 88.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.389 -0.82 . . . . 0.0 110.251 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -76.96 -32.93 57.63 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.463 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.58 -30.48 71.35 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 110.247 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.649 HD23 ' CD2' ' A' ' 80' ' ' TYR . 6.4 mt -84.98 -39.63 17.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.404 -0.81 . . . . 0.0 110.339 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.827 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 24.1 mt -68.85 -15.51 63.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.343 -0.848 . . . . 0.0 110.601 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.9 -21.1 64.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.267 -0.896 . . . . 0.0 110.622 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -109.66 -75.34 0.63 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.176 -0.952 . . . . 0.0 110.499 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.15 35.5 0.1 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.649 ' CD2' HD23 ' A' ' 75' ' ' LEU . 17.5 m-85 -98.35 16.43 21.59 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.378 -1.072 . . . . 0.0 110.438 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 11.1 tttm -44.98 -29.79 0.9 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -0.784 . . . . 0.0 110.831 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -73.64 -45.16 54.45 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 109.794 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.0 tm? -78.88 -40.19 33.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.505 -0.747 . . . . 0.0 109.861 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.24 -31.23 72.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.379 -0.826 . . . . 0.0 110.097 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -68.8 -34.87 76.24 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.45 -0.781 . . . . 0.0 110.21 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.9 tp -60.0 -45.76 91.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.382 -0.824 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.441 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.2 mt -77.38 -24.59 50.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.349 -0.844 . . . . 0.0 110.441 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.518 ' HA ' HD12 ' A' ' 91' ' ' ILE . 81.9 t60 -79.11 -42.51 26.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.264 -0.897 . . . . 0.0 110.488 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -60.76 -19.92 60.23 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.309 -0.87 . . . . 0.0 110.494 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -86.63 -19.26 56.94 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.61 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 78.7 mt -61.95 -51.14 77.43 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.187 -1.184 . . . . 0.0 110.728 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.61 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.6 Cg_endo . . . . . 0 C--N 1.315 -1.211 0 O-C-N 123.116 1.061 . . . . 0.0 110.635 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 121.135 0.493 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -60.25 -31.62 70.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.253 -0.904 . . . . 0.0 110.391 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.551 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -72.73 -39.3 67.0 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.351 -0.843 . . . . 0.0 110.07 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.714 ' HG3' HD12 ' A' ' 61' ' ' LEU . 11.7 ttt-85 -69.08 -26.28 64.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.514 -0.741 . . . . 0.0 110.187 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -76.08 -31.5 58.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.5 t -60.79 -56.3 22.81 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.371 -0.83 . . . . 0.0 110.173 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.71 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -55.31 -38.76 69.1 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.349 -0.844 . . . . 0.0 110.176 179.897 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.404 HD11 ' CZ ' ' A' ' 6' ' ' ARG . 84.8 mt -63.12 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.374 -0.829 . . . . 0.0 110.178 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -108.21 7.64 27.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.36 -0.837 . . . . 0.0 110.59 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.476 ' CE1' ' HG ' ' A' ' 86' ' ' LEU . 23.3 t-160 -103.86 32.35 3.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.171 -0.956 . . . . 0.0 109.92 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -75.06 -24.81 58.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.473 -0.767 . . . . 0.0 110.465 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -53.63 -35.74 61.28 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.194 -0.942 . . . . 0.0 110.379 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.83 -51.59 6.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.404 -0.81 . . . . 0.0 110.038 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.504 HD12 ' HB ' ' A' ' 20' ' ' ILE . 64.4 tp -57.44 -30.05 64.69 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 110.255 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -85.4 -33.16 22.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.435 -0.791 . . . . 0.0 110.371 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -67.5 -57.08 7.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.361 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -81.76 -65.2 1.04 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 110.391 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.504 ' HB ' HD12 ' A' ' 16' ' ' LEU . 14.8 mm -79.27 162.4 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.287 -0.883 . . . . 0.0 110.18 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.571 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.9 mttt -156.28 141.2 17.18 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.603 HG21 ' HG2' ' A' ' 52' ' ' ARG . 62.8 p -24.97 96.2 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.692 -0.63 . . . . 0.0 110.849 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.433 ' N ' ' O ' ' A' ' 21' ' ' LYS . 23.1 m -163.19 -175.96 4.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.617 -0.677 . . . . 0.0 110.304 -178.464 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.431 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.0 t80 -32.79 -40.56 0.05 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.831 -0.543 . . . . 0.0 112.176 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.637 ' CG2' HD21 ' A' ' 75' ' ' LEU . 41.5 mm -57.3 -65.71 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 120.918 -1.114 . . . . 0.0 110.029 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.461 ' HE3' HD23 ' A' ' 56' ' ' LEU . 10.5 mtm -75.86 -37.4 58.99 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.385 -0.822 . . . . 0.0 110.073 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 0.616 ' HA ' HD12 ' A' ' 30' ' ' ILE . 4.5 t70 -57.88 -50.54 73.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.428 -0.795 . . . . 0.0 110.358 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -55.59 -37.87 68.67 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.317 -0.864 . . . . 0.0 110.101 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.7 mtp -63.23 -38.43 91.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.409 -0.807 . . . . 0.0 110.131 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 27' ' ' ASP . 93.7 mt -61.87 -36.61 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.029 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.4 m -92.83 -19.78 21.37 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.301 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -56.22 -24.78 44.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.312 -0.868 . . . . 0.0 110.301 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.22 -12.34 3.82 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.674 ' C ' HD22 ' A' ' 35' ' ' LEU . 24.0 m-85 -67.53 -58.29 4.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.12 -1.224 . . . . 0.0 110.297 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.674 HD22 ' C ' ' A' ' 34' ' ' PHE . 3.9 mm? -109.58 165.14 11.89 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.326 -0.859 . . . . 0.0 110.225 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 42.8 p -65.14 163.56 14.77 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.079 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.1 mt -84.83 -27.87 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.284 -0.885 . . . . 0.0 110.177 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.5 m -62.35 -25.45 67.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.357 -0.839 . . . . 0.0 110.261 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.49 -29.31 65.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.833 . . . . 0.0 110.243 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.31 -53.89 52.19 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.326 -0.859 . . . . 0.0 110.25 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -59.63 -25.55 64.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.316 -0.865 . . . . 0.0 110.199 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.409 ' CG ' ' HG3' ' A' ' 46' ' ' GLU . 30.0 ttmt -76.46 -64.54 1.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.331 -0.856 . . . . 0.0 110.159 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.48 HG11 HD13 ' A' ' 56' ' ' LEU . 59.1 t -49.88 -33.65 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.493 -0.754 . . . . 0.0 110.699 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -42.13 -38.9 1.82 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.631 -0.668 . . . . 0.0 111.728 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -145.26 21.82 1.54 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.998 -1.064 . . . . 0.0 111.183 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.445 ' N ' ' HD2' ' A' ' 47' ' ' PRO . 2.2 tm-20 -79.02 -55.62 0.92 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 120.993 -1.067 . . . . 0.0 110.423 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' A' ' 46' ' ' GLU . 50.3 Cg_endo -75.67 170.05 21.01 Favored 'Trans proline' 0 C--N 1.313 -1.327 0 O-C-N 123.545 1.287 . . . . 0.0 110.553 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.6 m -136.51 -40.07 0.64 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 110.358 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -95.27 -161.76 0.89 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.851 . . . . 0.0 110.311 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -61.11 -16.63 46.26 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 110.64 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -56.7 -19.07 14.72 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.221 -0.924 . . . . 0.0 110.674 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.603 ' HG2' HG21 ' A' ' 22' ' ' THR . 73.0 ttt180 -50.6 -64.95 0.65 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.266 -0.897 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.472 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -61.98 -51.88 66.28 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -44.35 -46.37 9.31 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.483 -0.76 . . . . 0.0 111.091 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.6 tpt -67.01 -28.48 68.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.097 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 30' ' ' ILE . 14.3 tp -81.93 -35.58 28.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.326 -0.859 . . . . 0.0 110.71 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.6 ' HA ' HD12 ' A' ' 60' ' ' ILE . 3.3 mm -60.49 -36.27 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.216 -0.927 . . . . 0.0 110.504 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.1 mttp -70.1 -46.35 65.02 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.276 -0.89 . . . . 0.0 110.675 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.438 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.3 OUTLIER -56.2 -24.92 44.96 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.166 -0.958 . . . . 0.0 110.652 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.6 HD12 ' HA ' ' A' ' 57' ' ' ILE . 95.3 mt -69.71 -57.48 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.229 -0.919 . . . . 0.0 109.68 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.714 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.9 mm? -78.06 -35.52 49.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.563 -0.711 . . . . 0.0 110.854 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.73 -26.27 65.5 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -65.04 0.73 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.289 -0.882 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -160.1 169.12 24.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.253 -0.904 . . . . 0.0 110.268 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -82.92 -26.4 31.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.39 -0.819 . . . . 0.0 110.237 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -63.66 -39.48 94.45 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 110.24 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 12.1 t -60.54 -31.27 70.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.286 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CE2' HG12 ' A' ' 91' ' ' ILE . 1.9 t80 -62.99 -43.03 99.92 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.371 -0.831 . . . . 0.0 109.957 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.46 -37.15 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.0 t -67.47 -35.2 78.72 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.323 -0.861 . . . . 0.0 109.968 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.582 ' CE1' HD11 ' A' ' 75' ' ' LEU . 6.3 t80 -59.26 -29.9 67.89 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.41 -0.806 . . . . 0.0 109.8 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.523 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 37.7 t80 -70.35 -49.84 45.17 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.366 -0.834 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -73.81 -29.36 62.12 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.341 -0.849 . . . . 0.0 110.452 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.31 76.77 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.339 -0.851 . . . . 0.0 110.281 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.637 HD21 ' CG2' ' A' ' 25' ' ' ILE . 21.3 mt -84.15 -36.37 22.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.376 -0.828 . . . . 0.0 110.28 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.523 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 26.6 mt -67.43 -14.83 63.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.404 -0.81 . . . . 0.0 110.54 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -54.35 -24.0 17.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.272 -0.892 . . . . 0.0 110.69 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.64 -75.05 0.61 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.271 -0.893 . . . . 0.0 110.174 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.36 55.17 0.18 Allowed Glycine 0 N--CA 1.492 2.406 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -107.5 16.17 24.09 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -1.059 . . . . 0.0 110.575 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.683 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 26.0 ttmt -47.35 -34.96 7.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.274 -0.891 . . . . 0.0 110.77 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -48.99 36.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.362 -0.836 . . . . 0.0 109.86 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.427 ' O ' HD12 ' A' ' 87' ' ' LEU . 5.6 tt -69.37 -49.89 51.26 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 109.991 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.69 -28.33 69.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.461 -0.774 . . . . 0.0 110.171 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -59.83 -42.29 93.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.835 . . . . 0.0 110.195 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.476 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 48.1 tp -65.39 -30.79 71.64 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.371 -0.831 . . . . 0.0 110.191 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.504 HD22 ' CE2' ' A' ' 71' ' ' PHE . 1.1 mt -81.82 -27.89 33.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.399 -0.813 . . . . 0.0 110.109 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -77.53 -45.97 23.81 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.421 -0.8 . . . . 0.0 110.284 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.17 -19.96 65.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.355 -0.841 . . . . 0.0 110.328 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -81.01 -17.35 72.49 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.568 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 27.8 mt -65.62 -54.67 28.4 Favored Pre-proline 0 N--CA 1.493 1.69 0 O-C-N 121.19 -1.183 . . . . 0.0 110.68 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.568 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 45.2 Cg_endo . . . . . 0 C--N 1.314 -1.258 0 O-C-N 123.331 1.174 . . . . 0.0 110.684 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.409 ' O ' ' ND2' ' A' ' 7' ' ' ASN . . . . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.081 0.467 . . . . 0.0 110.296 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -58.76 -41.88 87.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.305 -0.872 . . . . 0.0 110.265 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.529 ' CB ' HG23 ' A' ' 91' ' ' ILE . . . -60.13 -40.91 91.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.34 -0.85 . . . . 0.0 110.087 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -64.15 -39.51 94.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.381 -0.825 . . . . 0.0 110.013 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.409 ' ND2' ' O ' ' A' ' 3' ' ' ALA . 62.6 m-80 -70.76 -27.55 64.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.405 -0.809 . . . . 0.0 110.032 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 t -62.08 -59.42 5.1 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.398 -0.814 . . . . 0.0 110.149 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.801 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -52.51 -35.68 53.65 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.311 -0.868 . . . . 0.0 109.987 179.732 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 mt -80.75 -21.52 40.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.36 -0.837 . . . . 0.0 110.53 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -115.45 24.57 11.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.923 . . . . 0.0 110.483 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.422 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 8.2 t-80 -130.95 34.07 4.11 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.303 -0.873 . . . . 0.0 110.12 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.4 ttp-105 -71.27 -25.17 62.34 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.363 -0.836 . . . . 0.0 110.256 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.14 -34.14 69.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.238 -0.914 . . . . 0.0 110.158 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.422 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -77.95 -44.56 26.5 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.431 -0.793 . . . . 0.0 110.038 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.696 HD22 HG12 ' A' ' 57' ' ' ILE . 3.5 tp -65.28 -38.68 91.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.308 -0.87 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.58 -42.99 79.61 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.324 -0.86 . . . . 0.0 110.12 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -81.75 -24.31 36.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.367 -0.833 . . . . 0.0 110.028 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -81.16 -64.86 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.285 -0.884 . . . . 0.0 110.179 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.916 HD13 HG13 ' A' ' 25' ' ' ILE . 19.9 mt -128.59 163.17 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 0.0 110.404 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.56 ' O ' ' C ' ' A' ' 22' ' ' THR . 9.2 mttt -125.48 142.41 51.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.616 -0.677 . . . . 0.0 109.383 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.571 HG23 ' HB2' ' A' ' 53' ' ' ALA . 66.7 p -24.05 98.37 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.549 0.69 . . . . 0.0 111.075 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' TYR . 40.0 m -155.85 -175.81 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.638 . . . . 0.0 110.036 -178.609 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -33.01 -36.47 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.895 -0.503 . . . . 0.0 112.039 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.916 HG13 HD13 ' A' ' 20' ' ' ILE . 42.9 mm -54.61 -65.17 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 120.99 -1.069 . . . . 0.0 110.221 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.496 ' HE1' HG13 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -75.41 -35.85 60.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.349 -0.845 . . . . 0.0 110.436 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.18 -48.96 77.73 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.34 -0.85 . . . . 0.0 110.564 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -55.86 -40.5 73.0 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.224 -0.923 . . . . 0.0 110.509 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -61.36 -50.27 73.57 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.328 -0.858 . . . . 0.0 110.237 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.953 HG23 ' HB2' ' A' ' 35' ' ' LEU . 21.1 mt -58.97 -25.52 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.392 -0.817 . . . . 0.0 110.418 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.3 m -96.89 -14.69 21.63 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.355 -0.841 . . . . 0.0 110.573 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -74.98 -3.0 29.75 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.238 -0.914 . . . . 0.0 110.771 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.15 8.17 7.36 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.66 ' C ' HD22 ' A' ' 35' ' ' LEU . 19.2 m-85 -80.38 -70.36 0.53 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.115 -1.227 . . . . 0.0 110.376 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.953 ' HB2' HG23 ' A' ' 30' ' ' ILE . 3.9 mm? -108.67 164.64 12.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.387 -0.82 . . . . 0.0 110.04 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.4 p -60.83 158.66 12.56 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.324 -0.86 . . . . 0.0 110.146 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -73.91 -28.15 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.364 -0.835 . . . . 0.0 110.136 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -59.96 -30.19 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.197 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.31 -26.85 63.97 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.387 -0.821 . . . . 0.0 110.212 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -68.39 -35.18 77.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.33 -0.856 . . . . 0.0 110.156 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -69.91 -30.63 68.1 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.388 -0.82 . . . . 0.0 110.075 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -66.62 -63.5 1.06 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 110.131 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.402 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 65.0 t -47.14 -33.56 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.45 -0.781 . . . . 0.0 110.644 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -46.55 -47.55 19.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.54 -0.725 . . . . 0.0 111.369 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -145.07 13.98 1.47 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.064 -1.022 . . . . 0.0 111.309 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.64 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 15.6 tp10 -80.59 -47.64 1.23 Allowed Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.043 -1.036 . . . . 0.0 110.974 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.64 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.7 Cg_endo -76.45 169.95 20.9 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.128 1.067 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.1 m -141.13 -46.8 0.39 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.372 -0.83 . . . . 0.0 110.169 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.76 -160.2 0.47 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.288 -0.882 . . . . 0.0 110.175 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -7.55 50.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.26 -0.9 . . . . 0.0 110.453 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -61.39 -17.12 52.59 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.157 -0.964 . . . . 0.0 110.447 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.472 ' HG2' HG21 ' A' ' 22' ' ' THR . 74.5 ttt180 -50.22 -59.61 3.78 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.244 -0.91 . . . . 0.0 110.387 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.651 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -66.08 -48.06 72.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.347 -0.846 . . . . 0.0 110.001 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -49.25 -34.07 14.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.421 -0.799 . . . . 0.0 110.487 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.9 ttt -79.55 -25.14 41.73 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.429 -0.794 . . . . 0.0 109.974 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.831 HD11 ' CD1' ' A' ' 30' ' ' ILE . 14.0 tp -79.16 -49.18 12.98 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.336 -0.853 . . . . 0.0 110.105 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.696 HG12 HD22 ' A' ' 16' ' ' LEU . 2.5 mp -56.8 -30.9 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.318 -0.864 . . . . 0.0 109.997 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -75.15 -43.36 52.89 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.345 -0.847 . . . . 0.0 110.191 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 17.3 mmt -58.46 -30.96 67.35 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.419 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.621 HD12 ' HA ' ' A' ' 57' ' ' ILE . 81.7 mt -68.18 -58.0 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.02 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.422 HD21 ' HG ' ' A' ' 9' ' ' LEU . 1.5 mm? -68.66 -40.34 80.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.375 -0.828 . . . . 0.0 110.502 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -55.58 -24.97 35.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.309 -0.869 . . . . 0.0 110.572 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -63.95 0.96 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.277 -0.89 . . . . 0.0 110.263 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -160.07 167.97 26.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.295 -0.878 . . . . 0.0 110.272 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -76.61 -36.46 57.46 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.17 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.37 -28.49 69.27 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.332 -0.855 . . . . 0.0 110.124 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.427 ' HG ' ' HE2' ' A' ' 34' ' ' PHE . 2.1 t -59.82 -48.58 81.11 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.38 -0.825 . . . . 0.0 110.139 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.801 ' CE1' HD23 ' A' ' 9' ' ' LEU . 4.0 t80 -57.71 -32.35 67.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.414 -0.804 . . . . 0.0 110.179 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.57 -44.09 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.333 -0.855 . . . . 0.0 109.939 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.4 t -65.51 -32.66 74.39 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.388 -0.82 . . . . 0.0 110.002 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.464 ' CE1' HD13 ' A' ' 87' ' ' LEU . 2.6 t80 -55.66 -41.54 73.79 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.339 -0.851 . . . . 0.0 109.857 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.74 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 38.4 t80 -62.71 -43.28 99.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.31 -0.869 . . . . 0.0 110.112 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -70.49 -24.83 62.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 110.404 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.88 -52.33 37.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.26 -0.9 . . . . 0.0 110.326 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.1 mt -62.72 -38.54 90.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.345 -0.847 . . . . 0.0 110.264 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.74 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 34.1 mt -66.91 -15.17 63.49 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.398 -0.814 . . . . 0.0 110.457 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.25 -22.93 66.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.25 -0.906 . . . . 0.0 110.478 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.69 -75.17 0.64 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.205 -0.935 . . . . 0.0 110.374 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.53 36.9 0.11 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.762 ' CE2' HD11 ' A' ' 20' ' ' ILE . 28.5 m-85 -92.9 16.38 12.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.493 -1.004 . . . . 0.0 110.441 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 21.8 tttp -42.4 -30.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.413 -0.804 . . . . 0.0 111.034 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -78.83 -48.86 13.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.314 -0.866 . . . . 0.0 109.913 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.656 ' C ' HD13 ' A' ' 83' ' ' LEU . 2.7 tm? -72.71 -48.59 37.54 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.013 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.52 -34.71 72.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.387 -0.82 . . . . 0.0 110.139 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.632 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.3 -36.1 77.12 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.358 -0.839 . . . . 0.0 110.082 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 39.3 tp -61.88 -40.32 95.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.302 -0.874 . . . . 0.0 110.327 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.464 HD13 ' CE1' ' A' ' 71' ' ' PHE . 1.1 mt -74.95 -30.04 61.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.359 -0.838 . . . . 0.0 110.276 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.457 ' HA ' HD12 ' A' ' 91' ' ' ILE . 5.6 t60 -84.97 -27.03 26.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.472 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.75 -23.19 42.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.318 -0.864 . . . . 0.0 110.31 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -80.41 -24.96 58.02 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.569 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.5 mt -59.63 -56.08 39.4 Favored Pre-proline 0 N--CA 1.493 1.685 0 O-C-N 121.189 -1.183 . . . . 0.0 110.45 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.569 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo . . . . . 0 C--N 1.313 -1.307 0 O-C-N 123.274 1.144 . . . . 0.0 110.705 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.137 0.494 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 ttmm -59.99 -34.98 74.05 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.349 -0.844 . . . . 0.0 110.552 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.43 82.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.234 -0.916 . . . . 0.0 110.139 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.449 ' O ' HD12 ' A' ' 10' ' ' LEU . 56.0 ttp180 -64.77 -31.75 73.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.333 -0.854 . . . . 0.0 109.997 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -74.88 -27.65 60.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.427 -0.796 . . . . 0.0 109.818 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 t -62.01 -50.65 71.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.431 -0.793 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.674 ' O ' HD13 ' A' ' 9' ' ' LEU . 2.1 tm? -59.38 -38.48 80.62 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.35 -0.844 . . . . 0.0 109.871 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 6' ' ' ARG . 12.0 mt -72.5 -30.69 64.73 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.334 -0.854 . . . . 0.0 110.147 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -81.97 -4.66 57.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.348 -0.845 . . . . 0.0 110.639 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.662 ' ND1' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -96.38 34.01 1.69 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.233 -0.917 . . . . 0.0 110.25 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -75.8 -41.57 52.43 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.846 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.28 -35.67 27.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.208 -0.933 . . . . 0.0 110.953 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.662 ' HB3' ' ND1' ' A' ' 12' ' ' HIS . . . -75.13 -25.85 58.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.077 -1.015 . . . . 0.0 110.267 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.576 HD11 ' CE ' ' A' ' 26' ' ' MET . 7.1 tt -85.28 -29.28 24.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.87 . . . . 0.0 109.831 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.69 -38.19 86.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 ttmt -84.34 -31.54 24.74 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 110.345 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -84.46 -65.54 1.0 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.312 -0.867 . . . . 0.0 110.364 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.534 HD12 HG13 ' A' ' 25' ' ' ILE . 15.2 mm -108.99 109.56 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.388 -0.82 . . . . 0.0 110.224 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.559 ' O ' ' C ' ' A' ' 22' ' ' THR . 34.3 mtpt -100.56 141.4 33.47 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.509 -0.744 . . . . 0.0 109.438 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.689 HG22 HD22 ' A' ' 56' ' ' LEU . 73.2 p -25.02 97.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.302 0 CA-C-O 121.49 0.662 . . . . 0.0 111.122 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 7.8 t -160.34 -176.25 5.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.473 -0.767 . . . . 0.0 110.285 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.444 ' CD1' ' HB2' ' A' ' 28' ' ' HIS . 9.2 t80 -33.28 -39.25 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.859 -0.526 . . . . 0.0 111.866 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.534 HG13 HD12 ' A' ' 20' ' ' ILE . 46.2 mm -57.74 -64.1 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.044 -1.035 . . . . 0.0 110.029 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.748 ' HB3' HD21 ' A' ' 56' ' ' LEU . 7.5 mmt -75.23 -34.36 61.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.323 -0.861 . . . . 0.0 110.198 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -59.38 4.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.456 -0.777 . . . . 0.0 110.402 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . 11.4 t-80 -54.52 -24.92 22.75 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.329 -0.857 . . . . 0.0 110.474 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.41 ' O ' ' CD2' ' A' ' 34' ' ' PHE . 33.8 mtt -72.41 -38.58 68.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -0.909 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.732 HD11 HD11 ' A' ' 56' ' ' LEU . 82.5 mt -61.39 -50.18 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.248 -0.908 . . . . 0.0 110.049 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.8 m -74.76 -15.57 60.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 110.455 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.45 -25.49 50.84 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.276 -0.89 . . . . 0.0 110.431 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 139.45 -13.72 3.22 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.484 ' CB ' HD12 ' A' ' 35' ' ' LEU . 17.4 m-30 -58.56 -61.83 2.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.14 -1.212 . . . . 0.0 110.44 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.708 HD22 ' OE1' ' A' ' 39' ' ' GLU . 3.9 mp -125.46 165.19 18.89 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.264 -0.897 . . . . 0.0 110.423 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 p -57.23 173.53 0.24 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.446 -0.784 . . . . 0.0 110.397 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.544 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.3 mp -85.35 -21.44 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.424 -0.797 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.9 m -57.91 -27.21 63.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.279 -0.888 . . . . 0.0 110.315 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.708 ' OE1' HD22 ' A' ' 35' ' ' LEU . 38.3 tt0 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.391 -0.818 . . . . 0.0 110.149 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -62.12 -32.26 72.81 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.361 -0.837 . . . . 0.0 110.114 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.84 -32.13 69.06 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.391 -0.818 . . . . 0.0 110.167 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -75.58 -54.94 6.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.06 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.6 t -53.36 -33.85 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.379 -0.826 . . . . 0.0 110.47 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -46.7 -36.57 7.29 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.378 -0.826 . . . . 0.0 110.878 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -144.17 20.8 1.75 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.282 -0.886 . . . . 0.0 110.543 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.7 tt0 -81.91 -57.02 0.53 Allowed Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 0.0 110.741 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 46.7 Cg_endo -72.49 170.09 20.19 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 O-C-N 123.307 1.162 . . . . 0.0 110.631 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 27.0 m -140.79 -43.03 0.39 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.436 -0.79 . . . . 0.0 110.1 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -98.33 -154.35 0.46 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.443 -0.786 . . . . 0.0 110.055 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -66.61 -12.55 58.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.281 -0.887 . . . . 0.0 110.609 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -57.47 -19.29 23.27 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.246 -0.909 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.612 ' HG2' HG21 ' A' ' 22' ' ' THR . 2.1 ttt85 -51.62 -36.41 45.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.275 -0.89 . . . . 0.0 110.715 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.423 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -85.98 -18.0 33.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 110.528 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -83.34 -34.49 25.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.179 -0.95 . . . . 0.0 110.287 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' MET . . . . . 0.473 ' HG2' ' HE1' ' A' ' 59' ' ' MET . 0.7 OUTLIER -77.52 -47.78 18.69 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.342 -0.849 . . . . 0.0 110.427 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.748 HD21 ' HB3' ' A' ' 26' ' ' MET . 17.7 tp -55.76 -40.76 73.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.355 -0.84 . . . . 0.0 110.548 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.655 ' HA ' HD12 ' A' ' 60' ' ' ILE . 0.9 OUTLIER -67.88 -26.4 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.337 -0.852 . . . . 0.0 109.957 179.885 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.3 mtmm -70.9 -48.76 51.92 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.233 -0.917 . . . . 0.0 109.924 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' MET . . . . . 0.473 ' HE1' ' HG2' ' A' ' 55' ' ' MET . 0.0 OUTLIER -52.77 -30.52 33.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.295 -0.878 . . . . 0.0 110.447 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.655 HD12 ' HA ' ' A' ' 57' ' ' ILE . 85.1 mt -63.88 -53.01 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.329 -0.857 . . . . 0.0 109.873 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.516 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.7 mm? -82.17 -27.31 32.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.458 -0.776 . . . . 0.0 110.699 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -60.74 -29.59 69.48 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.385 -0.822 . . . . 0.0 110.529 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -76.01 -65.07 0.96 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.24 -0.913 . . . . 0.0 110.389 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.28 169.99 22.05 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 0.0 110.218 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -80.58 -21.68 41.44 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.37 -0.831 . . . . 0.0 110.312 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -61.06 -39.37 89.59 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.18 -0.95 . . . . 0.0 110.232 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.4 t -60.11 -28.41 67.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.333 -0.854 . . . . 0.0 110.139 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.585 ' HE1' HD23 ' A' ' 9' ' ' LEU . 16.2 t80 -70.4 -35.83 73.7 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 109.954 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.59 -41.68 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.118 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.3 t -63.73 -36.84 85.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.299 -0.876 . . . . 0.0 110.182 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.574 ' CE1' HD22 ' A' ' 87' ' ' LEU . 5.9 t80 -57.05 -38.3 73.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.398 -0.814 . . . . 0.0 110.175 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.677 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 35.2 t80 -64.23 -43.33 95.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 110.372 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -76.84 -25.4 53.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.366 -0.834 . . . . 0.0 110.477 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.19 -35.84 80.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.284 -0.885 . . . . 0.0 110.45 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.536 HD11 ' CE2' ' A' ' 71' ' ' PHE . 11.6 mt -80.22 -40.98 26.02 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.607 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 39.2 mt -66.58 -14.97 63.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.712 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -63.71 -22.78 67.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.244 -0.91 . . . . 0.0 110.547 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -109.91 -75.27 0.63 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.207 -0.933 . . . . 0.0 110.459 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.04 37.0 0.1 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -94.45 16.47 15.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.506 -0.996 . . . . 0.0 110.588 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 38.5 ttpt -41.49 -32.39 0.33 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.483 -0.761 . . . . 0.0 110.929 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -67.35 -47.42 70.49 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.344 -0.848 . . . . 0.0 109.63 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.537 HD13 ' O ' ' A' ' 83' ' ' LEU . 1.1 tm? -69.94 -51.42 32.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.47 -0.769 . . . . 0.0 109.829 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.677 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.26 -30.04 69.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.44 -0.787 . . . . 0.0 110.202 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.604 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -58.83 -41.35 86.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.32 -0.863 . . . . 0.0 110.124 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.356 -0.84 . . . . 0.0 110.173 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.574 HD22 ' CE1' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -70.34 -34.48 72.7 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.318 -0.864 . . . . 0.0 110.214 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.455 ' HA ' HD12 ' A' ' 91' ' ' ILE . 13.9 t-80 -77.87 -16.63 58.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.348 -0.845 . . . . 0.0 110.493 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.15 -14.97 45.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.293 -0.879 . . . . 0.0 110.545 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -109.58 -22.82 6.53 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.568 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 19.3 mt -59.93 -57.39 27.12 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.198 -1.177 . . . . 0.0 110.437 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.568 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.2 Cg_endo . . . . . 0 C--N 1.313 -1.322 0 O-C-N 123.267 1.14 . . . . 0.0 110.564 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.73 0 CA-C-O 121.238 0.542 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -58.16 -41.02 82.92 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.381 -0.824 . . . . 0.0 110.301 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.0 -41.18 82.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.335 -0.853 . . . . 0.0 110.091 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -66.82 -32.87 74.43 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.365 -0.834 . . . . 0.0 110.07 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -75.23 -27.78 59.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.344 -0.848 . . . . 0.0 110.283 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.3 t -60.68 -58.35 8.84 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.261 -0.899 . . . . 0.0 110.111 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.757 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -57.58 -34.71 69.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.379 -0.826 . . . . 0.0 110.046 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.1 mt -81.27 -21.2 39.56 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.343 -0.848 . . . . 0.0 110.471 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -116.66 53.67 0.88 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.306 -0.871 . . . . 0.0 110.427 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.491 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 4.5 t-160 -159.78 42.37 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.333 -0.854 . . . . 0.0 109.772 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.533 ' CD ' ' HB2' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -75.15 -33.78 61.55 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.474 -0.766 . . . . 0.0 110.565 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -58.99 -35.49 73.31 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.217 -0.927 . . . . 0.0 110.23 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.491 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -85.43 -34.98 21.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.433 -0.792 . . . . 0.0 110.141 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.631 ' C ' HD13 ' A' ' 16' ' ' LEU . 3.0 tm? -64.1 -46.41 84.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.387 -0.821 . . . . 0.0 109.871 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -61.65 -43.52 98.7 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.492 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -66.11 -42.29 89.41 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.362 -0.836 . . . . 0.0 110.524 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.569 ' CG ' HD23 ' A' ' 83' ' ' LEU . 19.9 m-20 -80.28 -64.87 1.09 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.398 -0.814 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.774 HD12 HG13 ' A' ' 25' ' ' ILE . 24.9 mm -102.79 166.26 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.313 -0.867 . . . . 0.0 110.203 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.536 ' O ' ' C ' ' A' ' 22' ' ' THR . 38.9 mtmt -153.64 141.14 19.8 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.46 -0.775 . . . . 0.0 109.531 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.571 HG21 ' HG2' ' A' ' 52' ' ' ARG . 70.7 p -25.85 94.65 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 121.455 0.645 . . . . 0.0 111.175 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 21' ' ' LYS . 26.5 m -165.23 -175.85 3.82 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.632 -0.667 . . . . 0.0 109.923 -178.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.44 ' C ' ' O ' ' A' ' 23' ' ' SER . 7.9 t80 -33.66 -34.72 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.883 -0.511 . . . . 0.0 111.841 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.774 HG13 HD12 ' A' ' 20' ' ' ILE . 44.2 mm -53.49 -65.46 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.063 -1.023 . . . . 0.0 110.027 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.63 ' HE1' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -75.78 -37.9 58.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.23 -0.918 . . . . 0.0 110.216 179.55 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -57.65 -50.37 73.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.7 -33.17 69.88 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.247 -0.908 . . . . 0.0 110.075 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.0 mtt -68.41 -58.08 4.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.512 -0.742 . . . . 0.0 110.008 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.75 HG23 ' HB2' ' A' ' 35' ' ' LEU . 8.3 mt -56.47 -27.33 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.392 -0.817 . . . . 0.0 110.07 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 33.5 m -88.67 -22.62 23.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.344 -0.847 . . . . 0.0 110.261 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -59.76 -26.82 66.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.328 -0.858 . . . . 0.0 110.33 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.64 -15.2 2.91 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.546 ' CB ' HD12 ' A' ' 35' ' ' LEU . 25.0 m-85 -57.82 -47.67 81.95 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -1.175 . . . . 0.0 110.35 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.75 ' HB2' HG23 ' A' ' 30' ' ' ILE . 4.7 mp -132.07 165.13 24.7 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.347 -0.845 . . . . 0.0 110.387 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -70.43 171.85 9.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.39 -0.819 . . . . 0.0 110.265 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 49.4 mm -84.96 -18.77 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.824 . . . . 0.0 110.35 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.0 m -55.79 -26.25 45.21 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.24 -0.912 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.423 ' O ' HG23 ' A' ' 43' ' ' VAL . 26.9 tt0 -73.64 -28.03 61.57 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -71.56 -41.69 68.75 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.363 -0.835 . . . . 0.0 110.246 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -64.15 -27.69 69.25 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.32 -0.862 . . . . 0.0 110.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -80.19 -60.98 2.12 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.173 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 39' ' ' GLU . 65.3 t -48.41 -33.85 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.442 -0.787 . . . . 0.0 110.668 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -46.62 -42.72 16.61 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.464 -0.772 . . . . 0.0 111.173 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -145.22 17.25 1.54 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.114 -0.991 . . . . 0.0 110.974 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.63 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.1 OUTLIER -79.55 -47.66 1.5 Allowed Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.048 -1.033 . . . . 0.0 110.721 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -77.13 170.08 20.31 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.262 1.138 . . . . 0.0 110.334 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.8 m -129.25 -41.46 1.4 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.386 -0.821 . . . . 0.0 110.355 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -98.41 -159.61 0.75 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.355 -0.84 . . . . 0.0 110.363 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -65.74 -12.13 51.35 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.369 -0.832 . . . . 0.0 110.715 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -55.63 -20.03 12.43 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.152 -0.967 . . . . 0.0 110.678 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.571 ' HG2' HG21 ' A' ' 22' ' ' THR . 24.3 ttp180 -49.65 -37.43 28.28 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.177 -0.952 . . . . 0.0 110.592 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.771 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -79.1 -53.04 7.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.367 -0.833 . . . . 0.0 110.113 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.533 ' HB2' ' CD ' ' A' ' 13' ' ' ARG . . . -50.45 -26.47 5.12 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.44 -0.788 . . . . 0.0 110.619 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.8 tpt -82.99 -28.04 29.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.318 -0.864 . . . . 0.0 110.241 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.447 HD11 HD13 ' A' ' 30' ' ' ILE . 14.0 tp -84.89 -50.85 7.17 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.771 HD12 ' O ' ' A' ' 53' ' ' ALA . 2.7 mp -58.93 -36.66 62.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.328 -0.858 . . . . 0.0 110.072 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -66.56 -37.53 85.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.323 -0.861 . . . . 0.0 109.929 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.7 mmt -61.27 -27.79 68.71 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.413 -0.804 . . . . 0.0 110.14 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.689 HD12 ' HA ' ' A' ' 57' ' ' ILE . 87.0 mt -66.72 -53.62 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.354 -0.841 . . . . 0.0 109.889 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.423 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -77.47 -34.06 54.45 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.51 -0.744 . . . . 0.0 110.535 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -25.08 67.5 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.279 -0.888 . . . . 0.0 110.339 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -77.35 -64.51 1.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 110.355 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -153.6 166.49 32.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.388 -0.82 . . . . 0.0 110.371 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -85.21 -25.33 27.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.8 . . . . 0.0 110.246 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.48 -35.25 71.9 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.338 -0.851 . . . . 0.0 110.382 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.8 t -64.45 -34.07 77.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.354 -0.841 . . . . 0.0 110.127 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.609 ' HE1' HD23 ' A' ' 9' ' ' LEU . 18.5 t80 -60.58 -44.89 95.71 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.4 -0.812 . . . . 0.0 110.023 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.15 -34.29 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.804 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.8 t -73.58 -29.43 62.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.41 -0.806 . . . . 0.0 109.978 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.612 ' CE2' HD11 ' A' ' 75' ' ' LEU . 10.4 t80 -57.47 -44.54 84.93 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.499 -0.751 . . . . 0.0 109.771 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.583 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 46.3 t80 -61.05 -45.79 93.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.459 -0.776 . . . . 0.0 110.072 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -76.42 -23.58 53.99 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.351 -0.843 . . . . 0.0 110.577 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.89 -32.01 70.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.612 HD11 ' CE2' ' A' ' 71' ' ' PHE . 3.9 mt -84.9 -39.23 18.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.204 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.583 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 23.0 mt -67.2 -14.73 63.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.408 -0.808 . . . . 0.0 110.524 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 -56.78 -24.75 52.65 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.0 110.643 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -116.78 -75.08 0.58 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.167 -0.958 . . . . 0.0 110.394 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.37 67.35 0.14 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -125.08 16.37 8.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.406 -1.056 . . . . 0.0 110.509 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ttmt -44.34 -30.93 0.91 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.473 -0.767 . . . . 0.0 110.96 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.61 -49.12 67.34 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.355 -0.841 . . . . 0.0 109.791 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.659 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.1 tm? -78.84 -40.49 32.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.427 -0.795 . . . . 0.0 109.798 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.438 ' HB3' HD21 ' A' ' 76' ' ' LEU . . . -60.37 -45.91 91.83 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.1 -29.21 70.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.334 -0.854 . . . . 0.0 110.07 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 86' ' ' LEU . 23.2 tp -59.99 -50.19 74.72 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.446 -0.783 . . . . 0.0 110.212 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 mp -77.4 -25.3 50.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.258 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.472 ' HA ' HD12 ' A' ' 91' ' ' ILE . 2.0 t60 -68.74 -41.11 79.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.303 -0.873 . . . . 0.0 110.359 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.62 -22.19 64.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.259 -0.901 . . . . 0.0 110.543 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -84.9 -19.71 59.03 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.566 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.8 mt -60.67 -53.91 59.83 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.171 -1.193 . . . . 0.0 110.576 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.566 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.4 Cg_endo . . . . . 0 C--N 1.313 -1.317 0 O-C-N 123.271 1.143 . . . . 0.0 110.547 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.051 0.453 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -55.08 -34.64 63.78 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.283 -0.886 . . . . 0.0 110.379 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.56 -39.04 92.38 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -63.8 -30.24 71.36 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.388 -0.82 . . . . 0.0 109.851 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -72.82 -37.14 67.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.493 -0.754 . . . . 0.0 109.959 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.8 t -63.27 -50.18 71.15 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.374 -0.829 . . . . 0.0 110.156 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.759 ' O ' HD13 ' A' ' 9' ' ' LEU . 1.5 tm? -60.18 -36.58 77.92 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.277 -0.889 . . . . 0.0 109.913 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.9 mt -68.23 -31.04 70.25 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.85 . . . . 0.0 109.961 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -97.07 22.9 7.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.403 -0.81 . . . . 0.0 110.16 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.457 ' ND1' ' HB3' ' A' ' 15' ' ' ALA . 45.9 t-80 -107.97 23.25 14.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.898 . . . . 0.0 110.331 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.584 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 49.1 ttp180 -67.94 -47.5 68.53 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.232 -0.917 . . . . 0.0 110.003 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.71 -35.38 77.88 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.362 -0.836 . . . . 0.0 110.111 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.457 ' HB3' ' ND1' ' A' ' 12' ' ' HIS . . . -78.81 -43.87 24.37 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.399 -0.813 . . . . 0.0 110.074 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.898 HD21 ' CE ' ' A' ' 26' ' ' MET . 2.3 tm? -59.09 -50.36 74.36 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.296 -0.878 . . . . 0.0 109.692 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.91 -54.07 51.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.335 -0.853 . . . . 0.0 110.225 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -61.84 -27.55 68.86 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.29 -0.881 . . . . 0.0 110.167 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.697 ' HB3' HD11 ' A' ' 83' ' ' LEU . 63.6 m-20 -85.1 -65.19 1.04 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.41 -0.806 . . . . 0.0 110.317 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.905 HD13 HG13 ' A' ' 25' ' ' ILE . 22.1 mt -134.38 147.12 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.307 -0.87 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.58 ' O ' ' C ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -106.44 141.98 36.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.562 -0.711 . . . . 0.0 109.298 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.58 ' C ' ' O ' ' A' ' 21' ' ' LYS . 81.8 p -24.17 98.49 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.493 0.663 . . . . 0.0 110.891 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 24' ' ' TYR . 3.3 m -152.22 -175.68 5.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.69 -0.631 . . . . 0.0 110.183 -178.51 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.425 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -32.91 -37.43 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.896 -0.503 . . . . 0.0 112.064 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.905 HG13 HD13 ' A' ' 20' ' ' ILE . 44.3 mm -52.45 -65.25 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.901 -1.125 . . . . 0.0 110.169 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.898 ' CE ' HD21 ' A' ' 16' ' ' LEU . 2.1 mpt? -75.16 -50.49 16.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.891 . . . . 0.0 110.392 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -47.44 -51.53 19.86 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.526 -0.734 . . . . 0.0 111.228 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -55.26 -40.09 70.56 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.193 -0.942 . . . . 0.0 110.181 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.419 ' HE1' ' HB2' ' A' ' 71' ' ' PHE . 42.9 mtp -68.11 -32.52 72.87 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.398 -0.814 . . . . 0.0 110.433 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.492 HG23 ' HB2' ' A' ' 35' ' ' LEU . 39.7 mm -61.94 -65.43 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.34 -0.85 . . . . 0.0 110.405 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.2 m -59.94 -19.27 51.0 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.426 -0.796 . . . . 0.0 110.691 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -22.37 32.29 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.18 -0.95 . . . . 0.0 110.407 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.86 -14.53 3.35 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.722 ' C ' HD22 ' A' ' 35' ' ' LEU . 15.0 m-30 -60.91 -67.76 0.37 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.177 -1.19 . . . . 0.0 110.441 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.722 HD22 ' C ' ' A' ' 34' ' ' PHE . 3.8 mm? -113.25 150.05 32.94 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 110.251 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.8 p -62.58 175.18 0.83 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.393 -0.817 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.561 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.7 mp -77.68 -15.64 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.426 -0.797 . . . . 0.0 110.497 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.3 m -61.77 -31.25 71.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.236 -0.915 . . . . 0.0 110.415 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -70.92 -31.05 67.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.329 -0.857 . . . . 0.0 110.274 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -75.16 -27.67 59.81 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.34 -0.85 . . . . 0.0 110.433 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.76 -35.53 77.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.183 -0.948 . . . . 0.0 110.362 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -77.7 -59.75 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.228 -0.92 . . . . 0.0 110.265 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 78.8 t -47.42 -33.44 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.406 -0.809 . . . . 0.0 110.593 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -46.67 -53.17 12.22 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.588 -0.695 . . . . 0.0 111.505 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.82 4.75 2.57 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.05 -1.031 . . . . 0.0 111.645 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.578 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.9 tp10 -75.2 -47.49 4.49 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 120.917 -1.115 . . . . 0.0 110.884 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.0 Cg_endo -74.84 169.99 21.36 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.189 1.099 . . . . 0.0 110.455 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -152.65 -50.37 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.376 -0.827 . . . . 0.0 110.103 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.05 -160.71 0.3 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.379 -0.826 . . . . 0.0 110.076 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -66.76 -13.82 61.87 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.417 -0.802 . . . . 0.0 110.501 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -62.76 -16.29 57.18 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.494 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -51.82 -60.66 2.91 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.249 -0.907 . . . . 0.0 110.518 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.437 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -72.7 -48.37 39.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.324 -0.86 . . . . 0.0 110.299 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.584 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -46.76 -35.53 6.27 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.434 -0.791 . . . . 0.0 110.781 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -82.05 -25.02 34.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.364 -0.835 . . . . 0.0 109.932 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.412 HD23 HG22 ' A' ' 22' ' ' THR . 32.3 tp -80.17 -39.4 29.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 0.0 110.23 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.544 ' HA ' HD12 ' A' ' 60' ' ' ILE . 32.7 mm -63.37 -38.74 82.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 109.933 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.74 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 109.74 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.7 mmt -59.43 -27.81 66.38 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.404 -0.81 . . . . 0.0 110.012 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.544 HD12 ' HA ' ' A' ' 57' ' ' ILE . 91.5 mt -66.99 -49.81 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.515 -0.741 . . . . 0.0 109.959 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.415 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.5 mm? -80.69 -29.21 36.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.475 -0.766 . . . . 0.0 110.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -61.28 -28.92 69.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.317 -0.864 . . . . 0.0 110.451 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -65.27 0.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.386 -0.821 . . . . 0.0 110.249 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -160.24 170.1 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.397 -0.815 . . . . 0.0 110.187 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -81.31 -28.87 34.41 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.382 -0.824 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -61.69 -36.85 82.08 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.351 -0.843 . . . . 0.0 110.251 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 t -59.8 -37.46 79.18 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.658 ' CE1' HD23 ' A' ' 9' ' ' LEU . 11.6 t80 -60.31 -36.29 77.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.328 -0.857 . . . . 0.0 109.862 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.7 t -65.23 -35.58 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.42 -0.8 . . . . 0.0 109.856 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.1 t -69.58 -37.11 76.83 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.401 -0.812 . . . . 0.0 110.046 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.789 ' CE1' HD11 ' A' ' 75' ' ' LEU . 21.5 t80 -52.41 -39.67 61.21 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.429 -0.795 . . . . 0.0 109.918 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.751 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 47.2 t80 -62.46 -51.95 65.48 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.996 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -72.68 -20.6 61.21 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.324 -0.86 . . . . 0.0 110.562 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.78 -41.28 83.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.26 -0.9 . . . . 0.0 110.368 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.789 HD11 ' CE1' ' A' ' 71' ' ' PHE . 2.1 mt -80.03 -35.72 36.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.326 -0.858 . . . . 0.0 110.196 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.542 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 32.2 mt -65.0 -15.55 62.42 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.391 -0.818 . . . . 0.0 110.389 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -58.19 -21.36 47.2 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.203 -0.935 . . . . 0.0 110.467 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -116.96 -75.05 0.58 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.337 -0.852 . . . . 0.0 110.288 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.59 67.74 0.12 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 0.443 ' CZ ' HD11 ' A' ' 20' ' ' ILE . 12.3 m-85 -125.14 16.39 8.44 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.409 -1.053 . . . . 0.0 110.565 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.633 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 67.3 tttt -45.0 -37.55 4.12 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.319 -0.863 . . . . 0.0 110.814 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.64 -44.54 77.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.279 -0.888 . . . . 0.0 109.734 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.697 HD11 ' HB3' ' A' ' 19' ' ' ASP . 4.2 tt -70.24 -53.88 15.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.454 -0.779 . . . . 0.0 109.796 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.751 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.75 -26.58 67.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.431 -0.793 . . . . 0.0 110.322 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.633 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.36 -43.93 96.06 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.346 -0.846 . . . . 0.0 110.154 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.708 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.54 -43.13 99.42 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.363 -0.835 . . . . 0.0 109.852 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.472 HD12 ' O ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -73.33 -34.16 65.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.401 -0.812 . . . . 0.0 110.296 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.59 ' HA ' HD12 ' A' ' 91' ' ' ILE . 54.3 t-80 -70.01 -48.1 59.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.415 -0.803 . . . . 0.0 110.168 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.62 -18.93 61.48 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.361 -0.837 . . . . 0.0 110.405 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.45 -21.81 53.02 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.613 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 57.3 mt -59.26 -52.55 73.66 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.223 -1.163 . . . . 0.0 110.594 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.613 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.9 Cg_endo . . . . . 0 C--N 1.313 -1.293 0 O-C-N 123.328 1.173 . . . . 0.0 110.755 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 121.202 0.525 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.5 ttmt -51.08 -39.15 55.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.348 -0.845 . . . . 0.0 110.784 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -64.12 -41.23 97.32 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.242 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -67.39 -30.63 70.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.313 -0.867 . . . . 0.0 110.052 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -72.07 -27.43 62.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.375 -0.828 . . . . 0.0 110.062 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -63.21 -56.5 16.15 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.426 -0.796 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.749 ' O ' HD13 ' A' ' 9' ' ' LEU . 1.1 tm? -62.06 -34.8 76.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.414 -0.804 . . . . 0.0 109.777 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.5 mt -65.79 -33.67 76.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.34 -0.85 . . . . 0.0 110.014 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -94.04 18.9 9.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.333 -0.854 . . . . 0.0 110.267 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -103.45 26.24 8.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.924 . . . . 0.0 110.055 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.531 ' CD ' ' HB1' ' A' ' 54' ' ' ALA . 61.4 ttp180 -75.07 -50.47 16.33 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 110.063 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.94 -33.78 70.99 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.379 -0.826 . . . . 0.0 110.307 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -46.97 26.25 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.359 -0.838 . . . . 0.0 110.058 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.594 ' C ' HD13 ' A' ' 16' ' ' LEU . 3.4 tm? -57.44 -41.55 80.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.396 -0.815 . . . . 0.0 110.185 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.32 -45.4 76.33 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.34 -0.85 . . . . 0.0 110.454 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -85.2 -23.42 28.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.27 -0.893 . . . . 0.0 110.495 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.584 ' HB3' HD11 ' A' ' 83' ' ' LEU . 6.2 m-20 -74.11 -65.24 0.87 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.303 -0.873 . . . . 0.0 110.419 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.698 HD13 HG13 ' A' ' 25' ' ' ILE . 24.1 mt -146.9 143.35 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.322 -0.862 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.57 ' O ' ' C ' ' A' ' 22' ' ' THR . 8.4 mttt -94.78 142.57 27.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.589 -0.695 . . . . 0.0 109.162 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.57 ' C ' ' O ' ' A' ' 21' ' ' LYS . 80.9 p -23.5 97.58 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.618 -0.676 . . . . 0.0 110.921 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.2 t -146.32 -176.02 5.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.628 -0.67 . . . . 0.0 110.38 -178.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' SER . 13.8 t80 -33.15 -37.98 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.963 -0.46 . . . . 0.0 111.941 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.698 HG13 HD13 ' A' ' 20' ' ' ILE . 45.3 mm -57.5 -65.56 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.99 -1.069 . . . . 0.0 109.859 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.457 ' CE ' HD12 ' A' ' 57' ' ' ILE . 11.4 mmt -75.73 -25.27 56.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.459 -0.776 . . . . 0.0 110.323 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -71.15 -54.51 10.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.414 -0.804 . . . . 0.0 110.412 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.88 -32.62 63.86 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.292 -0.88 . . . . 0.0 110.378 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.8 mtp -62.48 -44.31 96.69 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 110.326 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.555 HG21 ' HB2' ' A' ' 40' ' ' GLU . 69.6 mt -63.82 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.397 -0.814 . . . . 0.0 110.199 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.4 m -79.53 -25.12 41.78 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.34 -0.85 . . . . 0.0 110.328 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.96 -20.72 55.05 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.242 -0.911 . . . . 0.0 110.363 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.07 -13.48 3.07 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.672 ' C ' HD12 ' A' ' 35' ' ' LEU . 7.9 m-30 -54.17 -66.6 0.37 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.207 -1.172 . . . . 0.0 110.4 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.672 HD12 ' C ' ' A' ' 34' ' ' PHE . 6.3 mp -128.34 165.19 21.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.358 -0.839 . . . . 0.0 110.212 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.7 p -56.31 154.4 8.23 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.399 -0.813 . . . . 0.0 110.396 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ILE . . . . . 0.43 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.2 mp -77.16 -23.66 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.405 -0.81 . . . . 0.0 110.32 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.1 m -64.59 -37.34 87.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.384 -0.822 . . . . 0.0 110.169 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.478 ' OE1' HD23 ' A' ' 35' ' ' LEU . 38.0 tt0 -68.1 -25.58 65.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.257 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.555 ' HB2' HG21 ' A' ' 30' ' ' ILE . 1.7 tt0 -74.95 -31.88 61.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.302 -0.874 . . . . 0.0 110.412 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.76 -32.42 72.99 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.336 -0.853 . . . . 0.0 110.306 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.23 -40.09 78.13 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.363 -0.835 . . . . 0.0 110.11 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 1.005 HG11 HD13 ' A' ' 56' ' ' LEU . 83.9 t -59.36 -34.35 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.366 -0.834 . . . . 0.0 110.265 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.07 -30.75 6.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.502 -0.749 . . . . 0.0 111.04 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -145.2 20.25 1.57 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.218 -0.926 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.546 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 10.3 tt0 -79.92 -57.24 0.69 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.096 -1.003 . . . . 0.0 110.355 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.546 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 47.7 Cg_endo -72.99 170.26 20.21 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 O-C-N 123.347 1.183 . . . . 0.0 110.52 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.8 m -131.07 -41.8 1.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -87.85 -162.38 0.81 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.362 -0.836 . . . . 0.0 110.224 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -71.46 -9.18 57.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.337 -0.852 . . . . 0.0 110.568 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -60.25 -17.51 42.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.544 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -50.94 -49.53 59.61 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.213 -0.929 . . . . 0.0 110.683 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.79 -61.82 1.7 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.894 . . . . 0.0 110.512 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.531 ' HB1' ' CD ' ' A' ' 13' ' ' ARG . . . -48.85 -39.6 26.3 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.498 -0.751 . . . . 0.0 111.036 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 ttm -65.34 -45.2 85.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 1.005 HD13 HG11 ' A' ' 43' ' ' VAL . 14.8 tp -59.25 -34.84 72.7 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.362 -0.836 . . . . 0.0 110.714 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.691 ' HA ' HD12 ' A' ' 60' ' ' ILE . 6.8 mm -61.19 -36.12 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 110.482 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -45.52 93.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.176 -0.953 . . . . 0.0 110.043 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.41 -28.86 46.62 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.287 -0.883 . . . . 0.0 110.463 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 57' ' ' ILE . 86.6 mt -65.82 -54.69 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.39 -0.819 . . . . 0.0 109.841 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -79.35 -30.31 42.59 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.468 -0.77 . . . . 0.0 110.715 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -58.96 -25.01 63.16 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.284 -0.885 . . . . 0.0 110.611 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.64 ' HB2' HD11 ' A' ' 35' ' ' LEU . 11.4 tttt -72.61 -65.29 0.81 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.312 -0.868 . . . . 0.0 110.367 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -160.25 170.12 21.79 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.271 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -75.47 -29.81 59.71 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.371 -0.831 . . . . 0.0 110.128 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -62.84 -33.75 75.89 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.357 -0.839 . . . . 0.0 110.309 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 t -60.2 -26.85 66.69 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.37 -0.831 . . . . 0.0 110.159 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.718 ' HE1' HD23 ' A' ' 9' ' ' LEU . 13.8 t80 -75.86 -37.62 58.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.415 -0.803 . . . . 0.0 110.111 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -70.5 -37.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.895 . . . . 0.0 110.164 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.0 t -69.04 -37.66 78.69 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.324 -0.86 . . . . 0.0 110.279 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.479 ' HE2' HD22 ' A' ' 87' ' ' LEU . 5.8 t80 -54.99 -40.77 70.43 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.266 -0.896 . . . . 0.0 109.879 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.528 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 29.1 t80 -61.71 -38.94 89.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.308 -0.87 . . . . 0.0 109.947 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -78.27 -23.8 47.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.388 -0.82 . . . . 0.0 110.482 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.2 81.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.265 -0.897 . . . . 0.0 110.367 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.0 mt -77.78 -37.33 49.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.344 -0.847 . . . . 0.0 110.114 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.528 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 39.6 mt -65.84 -15.05 62.54 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.453 -0.78 . . . . 0.0 110.467 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -63.4 -31.85 73.12 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -100.75 -75.68 0.58 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.26 -0.9 . . . . 0.0 110.519 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.26 35.31 0.1 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -94.71 16.01 16.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.445 -1.032 . . . . 0.0 110.484 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 26.9 tttt -47.79 -31.36 4.81 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.342 -0.849 . . . . 0.0 110.677 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.62 -54.47 23.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.405 -0.809 . . . . 0.0 109.807 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.584 HD11 ' HB3' ' A' ' 19' ' ' ASP . 5.6 tt -73.22 -41.19 64.02 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.411 -0.806 . . . . 0.0 109.928 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.93 82.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.42 -0.8 . . . . 0.0 109.924 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -61.25 -35.18 76.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.389 -0.82 . . . . 0.0 110.126 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.39 -42.22 91.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.331 -0.856 . . . . 0.0 110.23 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.479 HD22 ' HE2' ' A' ' 71' ' ' PHE . 0.9 OUTLIER -71.41 -42.81 67.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.409 -0.807 . . . . 0.0 110.232 -179.949 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.727 ' HA ' HD12 ' A' ' 91' ' ' ILE . 21.1 t60 -66.03 -32.92 74.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.385 -0.822 . . . . 0.0 110.305 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.19 -14.84 63.29 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.372 -0.83 . . . . 0.0 110.587 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -108.55 -3.73 32.59 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.727 HD12 ' HA ' ' A' ' 88' ' ' HIS . 19.3 mt -67.49 -54.98 15.97 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.046 -1.267 . . . . 0.0 110.375 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.542 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo . . . . . 0 C--N 1.313 -1.329 0 O-C-N 123.319 1.168 . . . . 0.0 110.65 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.074 0.464 . . . . 0.0 110.289 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.3 tttp -64.78 -43.93 91.65 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 110.291 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.63 85.45 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -62.53 -46.32 88.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.331 -0.856 . . . . 0.0 109.747 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -25.48 67.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.775 . . . . 0.0 110.125 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.5 t -58.77 -59.28 5.67 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.805 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -60.29 -38.49 83.77 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.383 -0.823 . . . . 0.0 109.82 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 28.9 mt -63.24 -29.33 70.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.723 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -99.66 14.74 29.05 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.541 -0.725 . . . . 0.0 110.257 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.503 ' CE1' HD21 ' A' ' 87' ' ' LEU . 29.3 t-80 -97.83 25.49 5.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.243 -0.91 . . . . 0.0 110.171 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 ttp-105 -72.31 -50.05 29.89 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.426 -0.796 . . . . 0.0 110.104 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -63.13 -27.05 69.12 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.29 -45.48 12.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.321 -0.862 . . . . 0.0 110.322 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 16' ' ' LEU . 2.8 tm? -64.32 -48.4 75.76 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.277 -0.889 . . . . 0.0 109.735 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -64.58 -33.27 75.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.369 -0.832 . . . . 0.0 110.125 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -82.93 -27.32 30.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.344 -0.848 . . . . 0.0 110.123 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.669 ' HB3' HD11 ' A' ' 83' ' ' LEU . 57.2 m-20 -84.2 -63.65 1.3 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -0.831 . . . . 0.0 110.145 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.666 HD13 HG13 ' A' ' 25' ' ' ILE . 27.3 mt -136.11 109.78 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.605 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.564 ' O ' ' C ' ' A' ' 22' ' ' THR . 6.6 mttt -62.15 142.69 57.48 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.353 -0.842 . . . . 0.0 109.241 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.772 HG21 ' HG2' ' A' ' 52' ' ' ARG . 11.7 p -23.62 97.64 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.677 0.751 . . . . 0.0 111.29 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 17.9 t -141.98 -176.28 4.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.665 -0.647 . . . . 0.0 110.316 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 16.4 t80 -33.42 -38.05 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.899 -0.5 . . . . 0.0 111.842 -179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.666 HG13 HD13 ' A' ' 20' ' ' ILE . 43.3 mm -58.87 -60.17 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.024 -1.047 . . . . 0.0 109.948 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.587 ' SD ' HD11 ' A' ' 60' ' ' ILE . 7.9 mmt -75.35 -28.04 59.43 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.324 -0.86 . . . . 0.0 110.233 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -74.78 -60.46 2.27 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.324 -0.86 . . . . 0.0 110.51 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -58.35 -25.78 62.38 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.386 -0.821 . . . . 0.0 110.624 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 ttt -70.6 -49.56 46.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.31 -0.869 . . . . 0.0 110.389 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.828 HD11 HD11 ' A' ' 56' ' ' LEU . 69.2 mt -60.01 -31.24 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.304 -0.872 . . . . 0.0 110.152 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 24.7 m -77.91 -14.98 59.36 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.434 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.07 -25.44 45.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.219 -0.926 . . . . 0.0 110.468 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.16 -11.48 3.85 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.538 ' CB ' HD12 ' A' ' 35' ' ' LEU . 23.1 m-85 -58.43 -58.63 7.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.125 -1.22 . . . . 0.0 110.308 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HB2' HG23 ' A' ' 30' ' ' ILE . 5.3 mp -116.04 163.3 16.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.361 -0.837 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -59.74 148.16 35.23 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.378 -0.826 . . . . 0.0 110.41 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 71.9 mt -69.75 -20.6 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.431 -0.793 . . . . 0.0 110.239 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -58.02 -27.35 63.46 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.306 -0.871 . . . . 0.0 110.28 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -67.14 -33.77 76.14 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 110.128 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -59.81 -37.5 79.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.361 -0.837 . . . . 0.0 110.206 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -68.68 -30.22 68.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.347 -0.846 . . . . 0.0 110.101 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -76.42 -57.86 3.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.388 -0.82 . . . . 0.0 110.048 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 66.8 t -48.99 -33.92 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.409 -0.807 . . . . 0.0 110.647 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -48.83 -40.93 31.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.456 -0.777 . . . . 0.0 111.312 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -145.22 18.59 1.56 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.117 -0.989 . . . . 0.0 111.178 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.626 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -81.1 -48.49 1.07 Allowed Pre-proline 0 N--CA 1.493 1.698 0 O-C-N 121.021 -1.049 . . . . 0.0 110.71 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.626 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.7 Cg_endo -77.0 170.15 20.32 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 O-C-N 123.182 1.096 . . . . 0.0 110.291 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -134.16 -46.52 0.77 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.321 -0.862 . . . . 0.0 110.135 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -90.14 -155.34 0.37 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.09 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -76.38 -3.28 36.12 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.254 -0.904 . . . . 0.0 110.674 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -59.91 -17.56 38.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.129 -0.982 . . . . 0.0 110.553 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.772 ' HG2' HG21 ' A' ' 22' ' ' THR . 69.2 ttt180 -51.55 -43.51 62.38 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.29 -0.881 . . . . 0.0 110.621 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.23 -7.69 57.62 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.277 -0.89 . . . . 0.0 110.599 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.02 -45.01 12.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.07 -1.019 . . . . 0.0 110.021 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.0 tpp -76.44 -33.39 58.76 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.38 -0.825 . . . . 0.0 109.912 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.828 HD11 HD11 ' A' ' 30' ' ' ILE . 1.1 tm? -61.17 -44.07 97.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.445 -0.784 . . . . 0.0 109.878 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.551 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -64.17 -45.89 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.388 -0.82 . . . . 0.0 109.73 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.8 mttp -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.298 -0.876 . . . . 0.0 109.855 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.8 mmt -59.84 -35.37 74.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.301 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.587 HD11 ' SD ' ' A' ' 26' ' ' MET . 96.7 mt -59.87 -52.77 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.401 -0.812 . . . . 0.0 110.121 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.28 -36.23 58.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.334 -0.854 . . . . 0.0 110.705 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -25.5 59.45 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.247 -0.908 . . . . 0.0 110.606 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -84.98 -64.94 1.07 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.87 165.22 34.7 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.266 -0.896 . . . . 0.0 110.226 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -85.13 -22.09 28.99 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.481 -0.762 . . . . 0.0 110.318 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -56.48 -32.79 65.35 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.403 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 21.7 t -73.14 -32.44 64.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.381 -0.824 . . . . 0.0 110.154 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.805 ' CE1' HD23 ' A' ' 9' ' ' LEU . 9.3 t80 -63.55 -46.46 85.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.02 -43.91 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.019 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -62.53 -36.37 82.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.363 -0.836 . . . . 0.0 110.111 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.426 ' CE1' HD11 ' A' ' 75' ' ' LEU . 5.9 t80 -53.58 -36.85 62.37 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.327 -0.858 . . . . 0.0 109.693 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.619 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.7 t80 -63.68 -43.27 97.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.436 -0.79 . . . . 0.0 109.827 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -76.56 -27.45 55.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.391 -0.818 . . . . 0.0 110.375 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.66 -51.49 69.15 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.287 -0.883 . . . . 0.0 110.26 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.631 HD21 ' CG2' ' A' ' 25' ' ' ILE . 68.3 mt -65.7 -38.78 90.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.422 -0.799 . . . . 0.0 110.239 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.619 HD11 ' CE1' ' A' ' 72' ' ' TYR . 58.6 mt -67.01 -14.99 63.44 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.347 -0.845 . . . . 0.0 110.482 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -56.94 -25.08 57.05 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.219 -0.925 . . . . 0.0 110.479 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.68 -75.01 0.61 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.314 -0.866 . . . . 0.0 110.375 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.71 60.43 0.15 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -114.36 16.32 17.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -1.04 . . . . 0.0 110.504 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -44.84 -30.05 0.91 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.39 -0.818 . . . . 0.0 110.781 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -67.84 -60.24 2.67 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.319 -0.863 . . . . 0.0 109.732 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 83' ' ' LEU . 5.2 tt -69.77 -37.47 76.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.371 -0.831 . . . . 0.0 109.892 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.471 ' CB ' HD21 ' A' ' 76' ' ' LEU . . . -62.09 -29.58 70.42 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.378 -0.826 . . . . 0.0 110.039 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.15 71.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.431 -0.793 . . . . 0.0 110.014 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.62 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -59.16 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.33 -0.857 . . . . 0.0 109.656 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.503 HD21 ' CE1' ' A' ' 12' ' ' HIS . 1.1 mt -72.61 -37.96 67.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.39 -0.819 . . . . 0.0 110.176 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.451 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 21.6 t-160 -60.73 -51.03 71.08 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.407 -0.808 . . . . 0.0 110.258 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.55 -20.01 52.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.325 -0.859 . . . . 0.0 110.326 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.51 2.13 70.13 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.649 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 8.6 mm -76.87 -57.94 1.12 Allowed Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.027 -1.278 . . . . 0.0 110.142 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.649 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.5 Cg_endo . . . . . 0 C--N 1.314 -1.256 0 O-C-N 123.207 1.109 . . . . 0.0 110.434 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.168 0.508 . . . . 0.0 110.309 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 ttmm -51.92 -33.61 38.0 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.291 -0.881 . . . . 0.0 110.71 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ALA . . . . . 0.403 ' HA ' ' HA ' ' A' ' 91' ' ' ILE . . . -67.63 -36.33 80.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.227 -0.92 . . . . 0.0 110.139 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.702 ' HG3' HD12 ' A' ' 61' ' ' LEU . 24.1 ttt180 -69.83 -30.34 67.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.399 -0.813 . . . . 0.0 109.969 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 0.504 ' HA ' HD12 ' A' ' 10' ' ' LEU . 92.6 m-20 -73.56 -28.92 62.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.394 -0.816 . . . . 0.0 110.172 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -62.56 -51.35 67.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 110.091 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.803 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.8 tm? -60.36 -34.64 74.15 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.344 -0.847 . . . . 0.0 109.843 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 7' ' ' ASN . 53.4 mt -62.6 -30.21 71.17 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.357 -0.839 . . . . 0.0 109.958 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -91.58 13.16 18.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.365 -0.834 . . . . 0.0 110.457 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CG ' HD21 ' A' ' 87' ' ' LEU . 42.7 t60 -96.02 22.34 7.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.283 -0.886 . . . . 0.0 110.2 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -75.35 -57.54 3.83 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.259 -0.901 . . . . 0.0 110.452 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.19 -35.12 73.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.375 -0.828 . . . . 0.0 110.49 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.49 -49.7 21.15 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.848 . . . . 0.0 110.166 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.663 HD13 ' CG1' ' A' ' 57' ' ' ILE . 7.8 tt -62.09 -32.44 72.99 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.404 -0.81 . . . . 0.0 110.255 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.01 -52.06 65.54 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.425 -0.797 . . . . 0.0 110.384 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -85.07 -25.16 27.75 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.336 -0.853 . . . . 0.0 110.48 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.612 ' HB3' HD11 ' A' ' 83' ' ' LEU . 78.9 m-20 -85.35 -65.39 1.02 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.238 -0.914 . . . . 0.0 110.773 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.9 mm -117.09 109.63 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.228 -0.92 . . . . 0.0 110.599 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.0 mttt -96.93 141.68 29.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.461 -0.774 . . . . 0.0 109.156 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.775 HG22 HD22 ' A' ' 56' ' ' LEU . 75.8 p -24.39 97.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.681 -0.637 . . . . 0.0 111.202 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 24' ' ' TYR . 41.8 t -156.78 -176.72 6.13 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.603 -0.685 . . . . 0.0 110.357 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.441 ' C ' ' O ' ' A' ' 23' ' ' SER . 14.8 t80 -33.63 -44.5 0.15 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.875 -0.515 . . . . 0.0 111.775 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.57 -52.59 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 120.963 -1.086 . . . . 0.0 109.893 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' MET . . . . . 0.521 ' HB3' HD21 ' A' ' 56' ' ' LEU . 6.9 mmt -75.38 -47.13 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.454 -0.779 . . . . 0.0 110.306 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.42 -62.17 2.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.421 -0.8 . . . . 0.0 110.793 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -53.01 -36.93 61.04 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.219 -0.926 . . . . 0.0 110.84 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' MET . . . . . 0.435 ' HG2' ' CE2' ' A' ' 34' ' ' PHE . 20.9 ttp -66.61 -42.82 86.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.278 -0.889 . . . . 0.0 110.342 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.4 HG13 ' CE ' ' A' ' 29' ' ' MET . 67.5 mt -72.47 -47.31 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.288 -0.882 . . . . 0.0 110.183 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.4 m -63.04 -18.61 63.53 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.283 -0.886 . . . . 0.0 110.48 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.31 -20.04 39.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.193 -0.942 . . . . 0.0 110.535 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.75 -5.05 5.46 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.435 ' CE2' ' HG2' ' A' ' 29' ' ' MET . 7.4 m-30 -55.82 -54.89 39.04 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.136 -1.214 . . . . 0.0 110.395 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.64 HD21 ' HB2' ' A' ' 63' ' ' LYS . 1.1 mp -129.07 165.11 21.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.365 -0.835 . . . . 0.0 110.077 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.9 p -56.85 145.17 30.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.378 -0.826 . . . . 0.0 110.492 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.4 mt -61.76 -23.89 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.432 -0.792 . . . . 0.0 110.28 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.9 m -59.36 -26.3 64.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.265 -0.897 . . . . 0.0 110.371 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.02 -46.64 83.56 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.273 -0.892 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.06 -32.43 73.8 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.398 -0.814 . . . . 0.0 110.157 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -64.89 -27.53 68.92 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt -84.85 -59.68 2.28 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.389 -0.82 . . . . 0.0 110.33 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' VAL . . . . . 1.02 HG11 HD13 ' A' ' 56' ' ' LEU . 58.4 t -48.14 -33.89 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.432 -0.793 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -47.82 -40.78 22.14 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.409 -0.807 . . . . 0.0 111.14 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.2 18.27 1.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.868 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.612 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.3 tm-20 -81.98 -48.16 0.95 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.108 -0.995 . . . . 0.0 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.612 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.4 Cg_endo -76.05 169.94 21.1 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.186 1.098 . . . . 0.0 110.359 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.5 m -128.6 -40.09 1.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 110.345 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -154.35 0.51 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.15 -12.59 41.31 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.25 -0.906 . . . . 0.0 110.83 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -51.75 -24.52 5.98 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.114 -0.991 . . . . 0.0 110.686 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.447 ' CD ' HG21 ' A' ' 22' ' ' THR . 29.4 ttm180 -55.27 -40.13 70.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.26 -0.9 . . . . 0.0 110.322 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.47 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -81.08 -11.54 59.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -0.874 . . . . 0.0 110.469 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.43 -47.76 9.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.988 . . . . 0.0 110.261 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.5 ttt -71.81 -37.85 70.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.84 . . . . 0.0 110.378 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 1.02 HD13 HG11 ' A' ' 43' ' ' VAL . 13.0 tp -60.36 -46.34 90.29 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.257 -0.902 . . . . 0.0 110.306 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.663 ' CG1' HD13 ' A' ' 16' ' ' LEU . 1.3 mp -72.51 -39.12 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.837 . . . . 0.0 109.987 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -64.49 -37.29 87.02 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.712 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.36 -31.35 70.24 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 109.939 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' A' ' 57' ' ' ILE . 97.1 mt -60.77 -54.74 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.407 -0.808 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.702 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.93 -27.69 64.97 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 110.601 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -67.68 -29.09 68.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.244 -0.91 . . . . 0.0 110.342 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.64 ' HB2' HD21 ' A' ' 35' ' ' LEU . 1.3 tmtt? -72.74 -64.97 0.85 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.257 -0.902 . . . . 0.0 110.235 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -160.09 166.7 29.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.391 -0.818 . . . . 0.0 110.182 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -81.05 -25.5 37.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.442 -0.786 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -62.27 -34.01 75.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.13 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -59.65 -37.93 80.06 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.376 -0.827 . . . . 0.0 110.012 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.803 ' CE1' HD23 ' A' ' 9' ' ' LEU . 10.4 t80 -66.39 -34.3 77.65 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 109.84 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.6 t -72.69 -40.46 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.0 110.05 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -67.06 -43.45 82.66 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.436 -0.79 . . . . 0.0 110.022 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.726 ' CE1' HD11 ' A' ' 75' ' ' LEU . 1.1 t80 -55.15 -29.89 58.72 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.38 -0.825 . . . . 0.0 109.789 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.678 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 26.9 t80 -67.57 -39.64 84.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.355 -0.841 . . . . 0.0 109.939 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -76.51 -34.52 58.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.414 -0.804 . . . . 0.0 110.308 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.8 -31.98 70.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.336 -0.853 . . . . 0.0 110.33 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.726 HD11 ' CE1' ' A' ' 71' ' ' PHE . 36.9 mt -82.88 -37.35 24.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.313 -0.867 . . . . 0.0 110.279 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.678 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 20.7 mt -70.13 -14.88 62.85 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.388 -0.82 . . . . 0.0 110.477 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -70.49 -23.1 62.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.098 -1.001 . . . . 0.0 110.742 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -106.26 -75.49 0.63 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.21 -0.931 . . . . 0.0 110.559 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.31 35.98 0.1 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -100.46 16.04 25.91 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.502 -0.999 . . . . 0.0 110.51 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 45.4 tttt -46.75 -31.78 3.19 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.352 -0.843 . . . . 0.0 110.711 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -67.07 -51.57 52.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.87 . . . . 0.0 109.694 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.612 HD11 ' HB3' ' A' ' 19' ' ' ASP . 4.9 tt -71.14 -48.79 49.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 109.99 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -57.9 -34.92 70.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.417 -0.802 . . . . 0.0 110.312 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.75 -36.02 77.85 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.364 -0.835 . . . . 0.0 110.029 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 0.421 HD23 ' C ' ' A' ' 86' ' ' LEU . 10.0 tt -62.43 -36.5 82.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.422 -0.799 . . . . 0.0 110.288 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.45 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.1 mt -80.83 -29.87 35.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.367 -0.833 . . . . 0.0 110.351 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.873 ' HA ' HD12 ' A' ' 91' ' ' ILE . 57.1 t-80 -75.31 -55.21 5.93 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.393 -0.817 . . . . 0.0 110.494 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.16 -19.13 52.42 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.289 -0.882 . . . . 0.0 110.588 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.86 -22.82 48.2 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.873 HD12 ' HA ' ' A' ' 88' ' ' HIS . 16.7 mt -56.94 -53.76 61.6 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.269 -1.136 . . . . 0.0 110.684 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.577 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 46.1 Cg_endo . . . . . 0 C--N 1.312 -1.353 0 O-C-N 123.289 1.152 . . . . 0.0 110.735 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.094 0.473 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -49.44 -37.05 24.34 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.39 -0.819 . . . . 0.0 110.707 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.15 99.34 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.355 -0.84 . . . . 0.0 110.111 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ARG . . . . . 0.511 ' NH1' HD11 ' A' ' 10' ' ' LEU . 5.8 ttp85 -65.78 -32.88 74.66 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.348 -0.845 . . . . 0.0 110.126 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -75.4 -25.0 57.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.321 -0.862 . . . . 0.0 110.143 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -62.23 -50.41 71.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.271 -0.893 . . . . 0.0 110.123 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.954 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -64.81 -36.42 84.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 ' NH1' ' A' ' 6' ' ' ARG . 50.8 mt -68.73 -31.61 70.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.428 -0.795 . . . . 0.0 109.909 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -96.84 27.7 3.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.415 -0.803 . . . . 0.0 110.01 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -112.07 36.57 3.29 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.803 . . . . 0.0 110.079 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.424 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 35.7 ttp180 -75.07 -64.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.497 -0.752 . . . . 0.0 110.297 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.83 -27.64 69.02 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.387 -0.821 . . . . 0.0 110.221 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.86 -50.24 74.24 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 110.317 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 19' ' ' ASP . 0.7 OUTLIER -75.09 -26.25 59.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 110.533 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.25 -46.06 54.57 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.264 -0.898 . . . . 0.0 110.64 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -85.25 -22.37 28.66 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.421 -0.799 . . . . 0.0 110.531 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . 69.5 m-20 -85.02 -64.99 1.06 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.701 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.83 HD13 HG13 ' A' ' 25' ' ' ILE . 43.4 mt -131.4 164.87 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.154 -0.966 . . . . 0.0 111.045 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.581 ' O ' ' C ' ' A' ' 22' ' ' THR . 15.6 mmtp -131.84 142.86 49.83 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.581 ' C ' ' O ' ' A' ' 21' ' ' LYS . 71.9 p -23.15 96.03 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 121.641 0.734 . . . . 0.0 110.993 -179.158 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' SER . . . . . 0.456 ' O ' ' C ' ' A' ' 24' ' ' TYR . 65.2 p -155.84 -175.5 5.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.69 -0.631 . . . . 0.0 110.089 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 0.456 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.8 t80 -32.59 -40.68 0.05 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.751 -0.593 . . . . 0.0 111.805 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.83 HG13 HD13 ' A' ' 20' ' ' ILE . 42.5 mm -55.56 -60.5 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.94 -1.1 . . . . 0.0 109.541 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.53 -34.96 60.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.404 -0.81 . . . . 0.0 110.092 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -67.32 -61.33 1.97 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.392 -0.818 . . . . 0.0 110.375 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -53.02 -24.98 10.86 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.274 -0.891 . . . . 0.0 110.456 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.1 mmt -78.16 -34.37 49.74 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.341 -0.849 . . . . 0.0 110.226 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.996 HD11 HD21 ' A' ' 56' ' ' LEU . 73.1 mt -81.96 -43.5 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -66.8 -19.82 65.82 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.36 -0.837 . . . . 0.0 110.485 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.69 -20.29 47.22 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.262 -0.899 . . . . 0.0 110.436 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.96 -6.25 4.75 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 0.422 ' HB2' ' HA ' ' A' ' 30' ' ' ILE . 8.7 m-30 -53.68 -58.41 7.3 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.102 -1.234 . . . . 0.0 110.454 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 63' ' ' LYS . 1.2 mt -132.03 165.06 24.84 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.303 -0.873 . . . . 0.0 110.292 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.4 p -55.48 144.31 26.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.375 -0.828 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.8 mt -74.37 -25.33 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 110.116 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -59.26 -46.1 89.43 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.378 -0.826 . . . . 0.0 110.364 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.72 -32.78 74.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.342 -0.849 . . . . 0.0 110.119 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -63.27 -45.71 90.23 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.816 . . . . 0.0 110.049 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.76 -29.94 60.45 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.375 -0.828 . . . . 0.0 110.114 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 26.0 ttmt -62.86 -54.72 34.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.428 -0.795 . . . . 0.0 109.946 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.2 t -44.7 -33.73 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.572 -0.705 . . . . 0.0 110.557 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -49.24 -33.76 13.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.552 -0.717 . . . . 0.0 111.291 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -145.35 14.09 1.42 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.052 -1.03 . . . . 0.0 111.628 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.5 tm-20 -82.05 -48.61 0.92 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 120.878 -1.139 . . . . 0.0 110.959 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.9 Cg_endo -77.97 160.19 30.46 Favored 'Trans proline' 0 C--N 1.314 -1.277 0 O-C-N 123.376 1.198 . . . . 0.0 110.709 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 49.3 m -126.87 -32.24 2.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.49 -0.756 . . . . 0.0 110.282 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 0.414 ' CD ' ' H ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -106.05 -164.07 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.32 -0.863 . . . . 0.0 110.202 179.603 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -19.06 21.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.327 -0.858 . . . . 0.0 110.628 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -52.49 -21.54 3.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.225 -0.922 . . . . 0.0 110.666 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -50.36 -65.27 0.59 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.297 -0.877 . . . . 0.0 110.649 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.601 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -66.08 -47.52 74.0 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.385 -0.822 . . . . 0.0 109.913 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.424 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -52.17 -33.56 41.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.354 -0.841 . . . . 0.0 110.394 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.3 ttt -81.31 -26.49 35.63 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.109 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.996 HD21 HD11 ' A' ' 30' ' ' ILE . 5.4 tt -73.05 -50.81 20.84 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.338 -0.851 . . . . 0.0 110.171 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.601 HD12 ' O ' ' A' ' 53' ' ' ALA . 3.1 mp -62.56 -37.57 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.399 -0.813 . . . . 0.0 109.913 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -37.35 84.09 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.268 -0.895 . . . . 0.0 109.634 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 28.5 mmm -60.94 -30.18 70.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.825 . . . . 0.0 110.102 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 57' ' ' ILE . 93.2 mt -62.32 -46.26 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.407 -0.808 . . . . 0.0 109.917 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.426 HD21 ' HG ' ' A' ' 9' ' ' LEU . 1.9 mm? -73.52 -28.64 62.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.438 -0.789 . . . . 0.0 110.547 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -40.16 94.63 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.465 ' HB2' HD21 ' A' ' 35' ' ' LEU . 11.5 tttm -61.38 -65.47 0.69 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.301 -0.874 . . . . 0.0 110.315 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.42 170.03 21.83 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.373 -0.829 . . . . 0.0 110.293 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -80.02 -30.12 39.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.383 -0.823 . . . . 0.0 110.142 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -62.38 -27.73 69.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.399 -0.813 . . . . 0.0 110.184 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . 0.403 ' OG ' ' CD2' ' A' ' 34' ' ' PHE . 2.9 t -62.85 -39.47 94.5 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.394 -0.816 . . . . 0.0 110.085 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 0.954 ' CE1' HD23 ' A' ' 9' ' ' LEU . 5.5 t80 -62.08 -39.61 93.01 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.418 -0.801 . . . . 0.0 110.015 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 63.5 t -64.9 -41.77 93.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.316 -0.865 . . . . 0.0 109.964 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 38.4 t -63.06 -37.35 86.85 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.388 -0.82 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 0.538 ' CE1' HD11 ' A' ' 75' ' ' LEU . 6.5 t80 -54.18 -35.96 62.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.371 -0.83 . . . . 0.0 109.767 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.691 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.4 t80 -63.59 -45.82 88.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.419 -0.8 . . . . 0.0 110.078 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -28.45 65.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.256 -0.903 . . . . 0.0 110.296 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.88 -55.64 30.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.3 -0.875 . . . . 0.0 110.419 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.538 HD11 ' CE1' ' A' ' 71' ' ' PHE . 11.9 mt -60.72 -35.96 77.63 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.374 -0.829 . . . . 0.0 110.39 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.691 HD11 ' CE1' ' A' ' 72' ' ' TYR . 30.3 mt -71.71 -14.98 62.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.446 -0.784 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -59.71 -33.06 71.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.194 -0.941 . . . . 0.0 110.656 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -105.52 -75.37 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -0.918 . . . . 0.0 110.392 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.95 35.22 0.1 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -95.68 16.32 17.65 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.36 -1.083 . . . . 0.0 110.311 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -45.0 -29.45 0.84 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.412 -0.805 . . . . 0.0 110.863 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.55 -50.17 72.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.269 -0.894 . . . . 0.0 109.757 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.656 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -74.56 -41.79 59.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.38 -0.825 . . . . 0.0 109.587 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.84 -32.47 73.69 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 109.999 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.98 -34.61 78.49 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.91 -46.73 87.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.301 -0.874 . . . . 0.0 110.455 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.8 mp -74.86 -47.41 30.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.336 -0.853 . . . . 0.0 110.332 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 67.8 t60 -59.85 -44.12 94.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.38 -0.825 . . . . 0.0 110.516 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -58.23 -20.64 43.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.329 -0.857 . . . . 0.0 110.534 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -107.08 14.15 40.52 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.63 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 7.8 mm -74.08 -57.12 2.42 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.259 . . . . 0.0 109.984 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.63 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo . . . . . 0 C--N 1.314 -1.286 0 O-C-N 123.347 1.182 . . . . 0.0 110.476 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.203 -1.353 0 CA-C-O 121.176 0.512 . . . . 0.77000000000000002 110.335 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 1.248 ' CE ' ' CG ' ' A' ' 4' ' ' LYS . 10.3 tttt -57.31 -37.56 72.67 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.424 -0.797 . . . . 2.0600000000000001 110.491 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.48 -39.39 93.29 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.155 -0.966 . . . . 0.37 110.154 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -66.43 -33.45 75.74 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.29 -0.881 . . . . 2.5299999999999998 110.11 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ASN . . . . . 1.038 ' ND2' ' CB ' ' A' ' 7' ' ' ASN . 3.3 m-20 -72.82 -28.64 62.67 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.395 -0.816 . . . . 1.21 110.182 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 t -61.13 -55.13 36.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.418 -0.801 . . . . 0.64000000000000001 110.249 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.772 HD13 ' O ' ' A' ' 9' ' ' LEU . 1.2 tm? -59.24 -36.03 74.74 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.029 -1.044 . . . . 0.35999999999999999 110.034 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 66.5 mt -71.01 -28.72 64.62 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.42 -0.8 . . . . 0.68000000000000005 110.242 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 1.178 ' NE2' ' CG ' ' A' ' 11' ' ' GLN . 55.1 tt0 -100.15 20.06 15.28 Favored 'General case' 0 C--O 1.171 -3.037 0 CA-C-O 121.526 0.679 . . . . 2.1400000000000001 110.53 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' HIS . . . . . 0.918 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 6.1 t-80 -112.83 30.88 6.8 Favored 'General case' 0 C--N 1.262 -3.2 0 O-C-N 120.166 -1.584 . . . . 2.27 111.541 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ARG . . . . . 0.706 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 49.2 ttp180 -72.97 -43.92 61.69 Favored 'General case' 0 C--N 1.274 -2.679 0 O-C-N 121.292 -0.88 . . . . 2.1600000000000001 110.929 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . 1.036 ' OE1' ' CG ' ' A' ' 14' ' ' GLU . 69.6 tt0 -62.25 -33.91 75.51 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.107 -0.995 . . . . 1.3100000000000001 110.455 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ALA . . . . . 0.918 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -78.43 -42.9 28.73 Favored 'General case' 0 C--O 1.195 -1.798 0 O-C-N 121.231 -0.918 . . . . 0.63 110.59 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' LEU . . . . . 1.306 ' CD2' ' CB ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.19 -38.93 86.22 Favored 'General case' 0 C--N 1.29 -1.995 0 O-C-N 121.1 -1.0 . . . . 1.49 110.152 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 1.058 ' OE1' ' CG ' ' A' ' 17' ' ' GLU . 60.2 tt0 -60.22 -41.99 94.21 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.466 -0.771 . . . . 1.73 110.638 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -78.11 -32.62 50.6 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.173 -0.954 . . . . 1.8400000000000001 110.575 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . 1.012 ' OD1' ' CB ' ' A' ' 19' ' ' ASP . 65.9 m-20 -82.75 -63.7 1.32 Allowed 'General case' 0 C--N 1.272 -2.768 0 O-C-N 120.337 -1.477 . . . . 1.3799999999999999 111.564 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ILE . . . . . 0.573 HD12 HG21 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -119.39 136.45 56.52 Favored 'Isoleucine or valine' 1 C--O 1.102 -6.689 0 O-C-N 120.73 -1.231 . . . . 1.04 112.225 -179.883 . . . . . . . . 4 4 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.68 ' O ' ' HB2' ' A' ' 23' ' ' SER . 88.5 mttt -112.85 141.99 46.03 Favored 'General case' 1 C--N 1.224 -4.851 0 O-C-N 116.772 -3.705 . . . . 1.95 109.125 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . 0.625 HG21 ' HG2' ' A' ' 52' ' ' ARG . 75.7 p -24.2 97.41 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.505 0.669 . . . . 0.48999999999999999 111.212 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' SER . . . . . 1.073 ' OG ' ' CB ' ' A' ' 23' ' ' SER . 0.4 OUTLIER -156.33 -176.21 5.84 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.409 -0.807 . . . . 1.1100000000000001 110.233 -178.648 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TYR . . . . . 1.392 ' CZ ' ' CD2' ' A' ' 24' ' ' TYR . 12.8 t80 -33.23 -39.82 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.805 -0.559 . . . . 1.26 111.943 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ILE . . . . . 0.573 HG21 HD12 ' A' ' 20' ' ' ILE . 44.0 mm -55.74 -62.7 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 120.962 -1.086 . . . . 0.32000000000000001 110.079 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' MET . . . . . 1.279 ' SD ' ' CE ' ' A' ' 26' ' ' MET . 1.6 mmt -75.54 -38.03 59.59 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.313 -0.867 . . . . 1.21 110.473 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ASP . . . . . 1.044 ' OD1' ' CB ' ' A' ' 27' ' ' ASP . 5.0 t70 -61.03 -53.87 51.87 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 120.89 -1.131 . . . . 1.1799999999999999 110.705 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' HIS . . . . . 1.408 ' CG ' ' CE1' ' A' ' 28' ' ' HIS . 18.4 t-160 -57.05 -34.22 68.01 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.887 -1.133 . . . . 1.22 110.361 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' MET . . . . . 1.344 ' CE ' ' CB ' ' A' ' 29' ' ' MET . 2.8 mtt -68.51 -41.82 79.44 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 120.943 -1.098 . . . . 2.7000000000000002 110.411 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ILE . . . . . 0.597 HG23 ' HB2' ' A' ' 35' ' ' LEU . 86.1 mt -64.15 -42.9 97.02 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.169 0 O-C-N 120.91 -1.119 . . . . 0.91000000000000003 110.382 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.1 m -77.52 -18.81 56.66 Favored 'General case' 0 C--N 1.283 -2.32 0 O-C-N 120.496 -1.377 . . . . 0.58999999999999997 110.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASP . . . . . 1.097 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 4.9 t70 -58.9 -22.85 60.28 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.087 -1.008 . . . . 1.3200000000000001 110.453 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.82 -12.49 3.4 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.109 -1.196 . . . . 0.39000000000000001 110.109 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PHE . . . . . 1.387 ' CZ ' ' CD1' ' A' ' 34' ' ' PHE . 12.7 m-30 -59.42 -61.51 2.57 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.851 -1.382 . . . . 1.29 110.37 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' LEU . . . . . 1.291 ' CD1' ' CB ' ' A' ' 35' ' ' LEU . 5.6 mp -119.39 162.93 17.98 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.214 -0.929 . . . . 1.3799999999999999 110.558 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.9 p -61.52 157.7 16.6 Favored 'General case' 0 C--O 1.199 -1.603 0 O-C-N 121.201 -0.937 . . . . 0.59999999999999998 110.344 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.3 mt -75.97 -22.36 15.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.2 0 O-C-N 120.807 -1.183 . . . . 1.21 110.459 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 m -59.17 -30.05 67.9 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.308 -0.87 . . . . 0.68999999999999995 110.456 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -67.07 -31.9 72.71 Favored 'General case' 0 C--N 1.283 -2.308 0 O-C-N 121.176 -0.952 . . . . 1.78 110.712 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 1.163 ' CD ' ' CB ' ' A' ' 40' ' ' GLU . 7.4 tt0 -65.89 -38.8 89.71 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.956 0.884 . . . . 2.3199999999999998 110.406 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' GLU . . . . . 1.127 ' OE2' ' CG ' ' A' ' 41' ' ' GLU . 32.5 tt0 -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.277 -2.576 0 O-C-N 120.946 -1.096 . . . . 1.75 110.692 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 10.5 ttmt -75.99 -56.95 4.18 Favored 'General case' 0 C--N 1.283 -2.311 0 O-C-N 120.903 -1.123 . . . . 1.52 110.407 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.0 t -50.12 -33.78 9.99 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.495 -0.753 . . . . 0.51000000000000001 110.638 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -47.38 -40.4 17.53 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.564 -0.71 . . . . 2.8199999999999998 111.613 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . 1.202 ' OD1' ' CB ' ' A' ' 45' ' ' ASN . 2.4 t30 -143.72 16.59 1.8 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.026 -1.046 . . . . 1.3500000000000001 111.225 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLU . . . . . 1.273 ' CD ' ' CB ' ' A' ' 46' ' ' GLU . 1.4 tt0 -80.24 -50.88 1.11 Allowed Pre-proline 0 C--N 1.299 -1.606 0 O-C-N 120.867 -1.145 . . . . 2.52 110.893 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.746 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.4 Cg_endo -75.81 168.81 23.52 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 O-C-N 123.127 1.067 . . . . 0.57999999999999996 110.465 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.5 m -135.94 -42.21 0.66 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.47 -0.769 . . . . 0.84999999999999998 110.517 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' GLN . . . . . 1.514 ' NE2' ' CG ' ' A' ' 49' ' ' GLN . 12.6 mm-40 -95.37 -159.05 0.69 Allowed 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.915 -1.116 . . . . 2.0099999999999998 110.063 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -65.74 -12.69 55.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.26 -0.9 . . . . 2.6099999999999999 110.952 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' GLN . . . . . 1.041 ' OE1' ' CG ' ' A' ' 51' ' ' GLN . 56.5 tt0 -56.36 -20.2 18.11 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.288 -0.882 . . . . 1.45 110.75 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 1.445 ' CD ' ' CZ ' ' A' ' 52' ' ' ARG . 45.5 ttt180 -51.44 -48.9 62.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.174 -0.954 . . . . 2.1099999999999999 110.752 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ALA . . . . . 0.637 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -77.3 -34.8 55.41 Favored 'General case' 1 C--O 1.147 -4.314 0 O-C-N 120.679 -1.263 . . . . 0.78000000000000003 110.318 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ALA . . . . . 0.706 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -63.15 -36.75 84.64 Favored 'General case' 1 C--N 1.241 -4.11 0 O-C-N 118.042 -2.911 . . . . 0.56999999999999995 110.666 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 55' ' ' MET . . . . . 1.393 ' CE ' ' CG ' ' A' ' 55' ' ' MET . 11.8 ttt -78.26 -34.54 48.97 Favored 'General case' 0 C--N 1.293 -1.858 0 O-C-N 121.194 -0.941 . . . . 1.76 110.246 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.3 tp -69.16 -41.58 77.06 Favored 'General case' 0 C--N 1.287 -2.152 0 O-C-N 120.616 -1.303 . . . . 0.82999999999999996 110.441 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.637 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -65.62 -37.37 79.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 O-C-N 121.1 -1.0 . . . . 0.59999999999999998 110.174 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -66.8 -39.91 87.93 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.044 -1.035 . . . . 1.3999999999999999 110.017 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' MET . . . . . 1.304 ' SD ' ' CE ' ' A' ' 59' ' ' MET . 5.6 mmt -58.62 -31.18 67.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.882 . . . . 1.4399999999999999 110.229 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' A' ' 57' ' ' ILE . 98.6 mt -63.59 -53.96 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.303 -0.873 . . . . 0.39000000000000001 109.938 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.459 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.0 mm? -75.24 -32.46 61.12 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.405 -0.809 . . . . 0.42999999999999999 110.672 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 1.47 ' CD ' ' NZ ' ' A' ' 62' ' ' LYS . 16.9 mmtt -61.19 -27.9 68.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.15 -0.969 . . . . 1.76 110.567 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 1.532 ' CG ' ' CE ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -73.43 -65.0 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.233 -0.917 . . . . 2.4700000000000002 110.363 -179.917 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 1.18 ' OD2' ' CB ' ' A' ' 64' ' ' ASP . 13.4 t0 -159.73 165.34 32.72 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.345 -0.847 . . . . 1.75 110.211 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ASN . . . . . 0.997 ' ND2' ' CB ' ' A' ' 65' ' ' ASN . 2.7 m-20 -80.07 -26.4 39.66 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.287 -0.883 . . . . 0.98999999999999999 110.32 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASP . . . . . 0.997 ' OD2' ' CB ' ' A' ' 66' ' ' ASP . 12.4 m-20 -61.43 -35.36 77.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.876 . . . . 1.24 110.347 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.4 t -62.59 -34.57 77.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.274 -0.891 . . . . 0.46999999999999997 110.162 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' TYR . . . . . 1.395 ' CZ ' ' CD2' ' A' ' 68' ' ' TYR . 19.3 t80 -64.33 -38.53 91.37 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.211 -0.931 . . . . 1.26 110.068 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.7 t -68.0 -39.32 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.281 -0.887 . . . . 0.32000000000000001 110.052 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -66.78 -36.53 82.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.23 -0.919 . . . . 0.27000000000000002 110.054 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' PHE . . . . . 1.426 ' CZ ' ' CD1' ' A' ' 71' ' ' PHE . 1.2 t80 -55.43 -37.43 67.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.288 -0.882 . . . . 1.24 109.886 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 1.367 ' CG ' ' CE2' ' A' ' 72' ' ' TYR . 44.8 t80 -64.41 -43.85 93.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 1.25 110.104 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASN . . . . . 1.011 ' ND2' ' CB ' ' A' ' 73' ' ' ASN . 8.9 t30 -75.44 -26.73 58.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.271 -0.893 . . . . 1.01 110.463 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.03 94.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.93 . . . . 0.32000000000000001 110.338 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' LEU . . . . . 0.449 HD11 ' CZ ' ' A' ' 71' ' ' PHE . 16.8 mt -75.26 -38.44 60.47 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.949 -1.095 . . . . 0.40000000000000002 110.274 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . 0.735 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.9 mt -67.25 -15.13 63.52 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.405 -0.809 . . . . 0.41999999999999998 110.554 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' HIS . . . . . 1.387 ' CG ' ' CE1' ' A' ' 77' ' ' HIS . 3.5 t-80 -62.32 -24.7 67.47 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 1.24 110.751 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLU . . . . . 1.447 ' OE1' ' CG ' ' A' ' 78' ' ' GLU . 28.0 mt-10 -109.74 -75.21 0.63 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.172 -0.955 . . . . 1.5900000000000001 110.414 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.89 47.77 0.15 Allowed Glycine 0 C--O 1.187 -2.791 0 N-CA-C 109.438 -1.465 . . . . 0.55000000000000004 109.438 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' TYR . . . . . 1.409 ' CG ' ' CE2' ' A' ' 80' ' ' TYR . 34.6 m-85 -106.16 16.22 25.23 Favored 'General case' 0 C--N 1.276 -2.599 0 O-C-N 120.029 -1.865 . . . . 1.3799999999999999 110.534 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . 1.423 ' CD ' ' NZ ' ' A' ' 81' ' ' LYS . 46.6 tttt -44.88 -31.59 1.3 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.424 -0.797 . . . . 1.6699999999999999 110.953 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . 1.005 ' OD1' ' CB ' ' A' ' 82' ' ' ASP . 2.7 m-20 -68.34 -51.98 38.38 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 1.26 109.9 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.413 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -72.12 -44.12 63.65 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.048 -1.033 . . . . 1.52 110.174 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.02 -35.06 74.25 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.405 -0.81 . . . . 0.46000000000000002 110.228 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -62.43 -36.0 81.02 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.306 -0.871 . . . . 0.5 110.169 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 86' ' ' LEU . . . . . 1.284 ' CD2' ' CB ' ' A' ' 86' ' ' LEU . 9.1 tp -60.31 -43.54 96.25 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.35 -0.844 . . . . 1.5900000000000001 110.368 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' LEU . . . . . 0.481 ' O ' HG13 ' A' ' 91' ' ' ILE . 0.9 OUTLIER -75.29 -35.44 61.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.208 -0.933 . . . . 0.56000000000000005 110.25 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 88' ' ' HIS . . . . . 1.431 ' CG ' ' CE1' ' A' ' 88' ' ' HIS . 22.7 t-80 -68.97 -39.25 79.57 Favored 'General case' 0 C--O 1.187 -2.226 0 O-C-N 120.93 -1.106 . . . . 1.3200000000000001 110.559 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ASP . . . . . 0.981 ' OD1' ' CB ' ' A' ' 89' ' ' ASP . 53.4 m-20 -69.67 -18.87 63.6 Favored 'General case' 0 C--N 1.278 -2.542 0 O-C-N 120.165 -1.585 . . . . 1.3200000000000001 110.908 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.63 -14.78 52.21 Favored Glycine 0 C--O 1.189 -2.681 0 C-N-CA 119.709 -1.234 . . . . 0.63 110.363 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' ILE . . . . . 0.624 HD12 ' HA ' ' A' ' 88' ' ' HIS . 33.9 mt -64.75 -54.33 36.72 Favored Pre-proline 0 C--N 1.286 -2.188 0 O-C-N 120.488 -1.596 . . . . 0.70999999999999996 110.452 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' PRO . . . . . 0.61 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.7 Cg_endo . . . . . 0 C--O 1.178 -2.525 0 O-C-N 123.158 1.083 . . . . 0.81000000000000005 110.762 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 tpp . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.155 0.503 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 2' ' ' ASP . 38.3 p-10 -106.65 99.53 9.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.413 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.49 -25.5 57.37 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.262 -0.899 . . . . 0.0 110.211 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -59.16 -35.71 74.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 110.516 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.552 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -56.06 -40.78 74.08 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.096 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.734 ' O ' HD12 ' A' ' 10' ' ' LEU . 4.0 ttp180 -62.29 -32.49 73.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.37 -0.831 . . . . 0.0 109.653 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -77.88 -25.14 48.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.924 179.554 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 t -59.75 -54.19 49.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.935 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.958 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -62.47 -36.92 84.0 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.406 -0.809 . . . . 0.0 109.614 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.734 HD12 ' O ' ' A' ' 6' ' ' ARG . 12.3 mt -67.93 -35.3 78.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 109.54 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -90.79 2.64 55.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.42 -0.8 . . . . 0.0 110.122 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -92.59 19.04 7.78 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.302 -0.874 . . . . 0.0 110.224 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -69.21 -44.29 72.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 110.138 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.48 -32.61 74.32 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.395 -0.815 . . . . 0.0 110.169 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.28 -42.31 55.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.326 -0.859 . . . . 0.0 110.169 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HG ' ' HB ' ' A' ' 20' ' ' ILE . 5.2 tt -75.93 -37.42 58.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.426 -0.796 . . . . 0.0 110.244 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -53.53 -41.44 66.38 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.406 -0.809 . . . . 0.0 110.469 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -85.46 -34.32 21.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.512 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.22 -65.53 1.0 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.256 -0.903 . . . . 0.0 110.782 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.477 ' HB ' ' HG ' ' A' ' 16' ' ' LEU . 11.0 mm -108.44 111.13 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.295 -0.878 . . . . 0.0 110.647 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.565 ' O ' ' C ' ' A' ' 22' ' ' THR . 4.3 mtpt -97.06 141.75 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.598 -0.689 . . . . 0.0 109.349 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 21' ' ' LYS . 69.5 p -24.44 97.4 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 CA-C-O 121.455 0.645 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 27.5 t -157.36 -176.8 6.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.556 -0.715 . . . . 0.0 110.154 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 15.9 t80 -33.54 -41.58 0.09 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.773 -0.58 . . . . 0.0 111.788 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.44 HG13 HD12 ' A' ' 20' ' ' ILE . 44.0 mm -59.38 -50.01 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.053 -1.03 . . . . 0.0 110.007 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.571 ' HE1' HD11 ' A' ' 60' ' ' ILE . 0.6 OUTLIER -75.65 -37.49 59.62 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.339 -0.851 . . . . 0.0 110.439 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -72.35 -57.56 4.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.255 -0.903 . . . . 0.0 110.605 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -51.7 -25.22 6.87 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.313 -0.867 . . . . 0.0 110.579 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.6 -57.07 3.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.308 -0.87 . . . . 0.0 110.174 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.669 HG23 ' HB2' ' A' ' 35' ' ' LEU . 83.9 mt -57.12 -47.33 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.271 -0.893 . . . . 0.0 109.937 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 75.0 m -66.27 -15.15 62.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.377 -0.827 . . . . 0.0 110.36 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -59.67 -28.91 67.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.284 -0.885 . . . . 0.0 110.395 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.32 -18.11 1.33 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.186 -1.166 . . . . 0.0 110.186 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -54.5 -60.7 2.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.122 -1.222 . . . . 0.0 110.315 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.669 ' HB2' HG23 ' A' ' 30' ' ' ILE . 1.1 mt -121.66 162.97 19.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.417 -0.802 . . . . 0.0 110.265 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.8 p -60.72 147.73 41.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.343 -0.848 . . . . 0.0 110.401 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 88.8 mt -71.37 -17.84 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.398 -0.814 . . . . 0.0 110.242 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 m -58.82 -27.88 65.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.326 -0.859 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.469 ' O ' HG23 ' A' ' 43' ' ' VAL . 23.0 tt0 -68.43 -26.51 65.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.4 -0.813 . . . . 0.0 110.159 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -63.32 -49.14 75.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.361 -0.837 . . . . 0.0 110.192 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -60.75 -27.97 68.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 110.182 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -77.92 -58.58 3.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 110.064 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.695 HG11 HD13 ' A' ' 56' ' ' LEU . 65.9 t -50.91 -33.4 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.408 -0.808 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.6 ttp85 -50.8 -42.86 58.55 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.256 -0.903 . . . . 0.0 111.34 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -134.27 8.95 3.73 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.029 -1.044 . . . . 0.0 111.455 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.584 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.0 tp10 -73.96 -53.6 3.96 Favored Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.033 -1.042 . . . . 0.0 110.186 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -74.41 170.29 20.57 Favored 'Trans proline' 0 C--N 1.313 -1.325 0 O-C-N 123.388 1.204 . . . . 0.0 110.269 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.3 m -135.84 -38.23 0.72 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.391 -0.818 . . . . 0.0 110.436 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -104.25 -157.46 0.61 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.849 . . . . 0.0 110.262 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -58.09 -19.83 35.1 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.344 -0.847 . . . . 0.0 110.55 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.475 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 7.4 tt0 -52.84 -23.82 7.77 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.238 -0.913 . . . . 0.0 110.56 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG2' HG21 ' A' ' 22' ' ' THR . 21.1 ttp180 -52.98 -53.14 54.31 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.265 -0.897 . . . . 0.0 110.319 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.517 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -80.67 -8.65 59.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.86 . . . . 0.0 110.412 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.475 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -83.85 -36.01 23.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.1 -1.0 . . . . 0.0 110.054 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.4 tpp -81.21 -27.4 35.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.353 -0.842 . . . . 0.0 110.162 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.695 HD13 HG11 ' A' ' 43' ' ' VAL . 14.3 tp -68.87 -38.22 79.57 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.364 -0.835 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.572 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.1 mp -74.15 -45.76 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.317 -0.864 . . . . 0.0 109.825 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -60.64 -38.44 84.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.256 -0.902 . . . . 0.0 109.675 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.4 mmt -56.55 -36.06 68.84 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.386 -0.821 . . . . 0.0 110.113 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.571 HD11 ' HE1' ' A' ' 26' ' ' MET . 79.1 mt -58.02 -52.47 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.322 -0.861 . . . . 0.0 109.916 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.467 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.5 mm? -77.37 -29.43 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.412 -0.805 . . . . 0.0 110.706 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -58.58 -25.89 63.04 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.183 -0.948 . . . . 0.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.8 tptm -83.68 -65.57 0.99 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.908 . . . . 0.0 110.271 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -160.54 170.19 21.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.374 -0.829 . . . . 0.0 110.297 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -84.16 -20.11 32.98 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.421 -0.799 . . . . 0.0 110.271 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -60.41 -43.04 97.11 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.25 -0.906 . . . . 0.0 110.294 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.1 t -61.32 -32.48 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.41 -0.806 . . . . 0.0 110.309 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.958 ' CE1' HD23 ' A' ' 9' ' ' LEU . 6.4 t80 -64.1 -37.18 86.51 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.384 -0.823 . . . . 0.0 110.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.07 -31.82 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.37 -0.831 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.0 t -69.88 -43.57 71.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.294 -0.879 . . . . 0.0 110.019 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.666 ' CE1' HD11 ' A' ' 75' ' ' LEU . 1.1 t80 -53.93 -35.69 61.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.334 -0.854 . . . . 0.0 109.612 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.473 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 25.2 t80 -63.74 -38.5 91.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.499 -0.75 . . . . 0.0 109.858 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -82.96 -25.52 32.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.405 -0.809 . . . . 0.0 110.158 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.43 80.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.666 HD11 ' CE1' ' A' ' 71' ' ' PHE . 45.1 mt -78.36 -40.08 37.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.42 -0.8 . . . . 0.0 110.151 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.43 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.5 mt -65.68 -15.5 62.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.359 -0.838 . . . . 0.0 110.397 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -65.36 -26.32 67.97 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.224 -0.922 . . . . 0.0 110.58 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -108.01 -75.16 0.64 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.922 . . . . 0.0 110.595 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.0 62.93 0.11 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -124.93 16.25 8.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.435 -1.039 . . . . 0.0 110.478 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -46.32 -29.21 1.56 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.376 -0.827 . . . . 0.0 111.031 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.13 -65.05 0.75 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.301 -0.875 . . . . 0.0 110.077 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 87' ' ' LEU . 8.5 tt -66.77 -39.8 87.99 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.45 -39.26 60.86 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.278 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.16 90.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.791 . . . . 0.0 109.902 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 8.6 tt -52.52 -46.4 66.67 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.4 -0.812 . . . . 0.0 110.568 179.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.3 mp -73.06 -48.5 35.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.358 -0.839 . . . . 0.0 110.288 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.614 ' HA ' HD12 ' A' ' 91' ' ' ILE . 78.1 t60 -65.37 -16.09 63.25 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.388 -0.82 . . . . 0.0 110.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -85.02 -14.77 46.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.191 -0.943 . . . . 0.0 110.747 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -111.33 -22.86 5.97 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.624 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 54.7 mt -60.59 -52.06 75.39 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.154 -1.204 . . . . 0.0 110.822 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.624 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.6 Cg_endo -72.09 -88.44 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.23 0 O-C-N 123.221 1.116 . . . . 0.0 110.581 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 97' ' ' SER . 58.0 t -105.87 165.84 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.049 -1.032 . . . . 0.0 109.958 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.463 ' N ' HG12 ' A' ' 93' ' ' VAL . 54.3 t -84.26 -68.62 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.29 -0.881 . . . . 0.0 110.04 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.1 t -164.91 -52.89 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.388 -0.82 . . . . 0.0 110.091 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.5 p -93.69 -60.57 1.73 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.357 -0.84 . . . . 0.0 110.175 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' SER . . . . . 0.506 ' O ' HG13 ' A' ' 93' ' ' VAL . 42.4 m . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.195 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.198 0.523 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.44 ' OD1' ' N ' ' A' ' 2' ' ' ASP . 37.9 p-10 -133.61 99.89 4.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.447 -0.783 . . . . 0.0 110.304 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.56 -31.34 72.51 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.272 -0.892 . . . . 0.0 110.326 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.778 ' HE3' HG23 ' A' ' 94' ' ' VAL . 49.1 tttp -63.35 -32.43 73.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.263 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.32 95.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.382 -0.824 . . . . 0.0 110.071 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.641 ' HG3' HD12 ' A' ' 61' ' ' LEU . 28.5 ttt180 -65.62 -29.66 70.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.367 -0.833 . . . . 0.0 110.126 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.42 ' HA ' HD12 ' A' ' 10' ' ' LEU . 28.1 m120 -74.08 -31.73 62.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.4 -0.813 . . . . 0.0 110.142 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 47.1 t -60.63 -51.9 67.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.4 -0.812 . . . . 0.0 110.294 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.821 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER -61.98 -35.26 77.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.368 -0.832 . . . . 0.0 110.057 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 7' ' ' ASN . 67.4 mt -63.14 -34.36 77.44 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.278 -0.889 . . . . 0.0 109.89 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -97.02 24.98 5.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.391 -0.818 . . . . 0.0 110.066 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 22.4 t-80 -94.81 20.02 9.33 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.336 -0.853 . . . . 0.0 110.451 -179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 70.4 ttp85 -69.29 -56.94 6.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.308 -0.87 . . . . 0.0 110.114 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -65.14 -35.27 80.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.289 -0.882 . . . . 0.0 110.101 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.0 -46.24 65.55 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.371 -0.831 . . . . 0.0 110.298 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.474 HD22 HG13 ' A' ' 57' ' ' ILE . 1.2 tp -59.35 -39.95 84.85 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.38 -41.64 66.09 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.403 -0.811 . . . . 0.0 110.265 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -85.06 -23.22 28.65 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.391 -0.818 . . . . 0.0 110.152 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.99 -65.25 1.03 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.256 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.768 HD13 HG13 ' A' ' 25' ' ' ILE . 14.8 mt -147.24 158.38 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.335 -0.853 . . . . 0.0 110.52 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.577 ' O ' ' C ' ' A' ' 22' ' ' THR . 5.6 mttt -114.34 141.91 47.0 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 21' ' ' LYS . 58.9 p -24.23 98.75 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 CA-C-O 121.516 0.674 . . . . 0.0 110.999 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.8 t -152.06 -176.22 5.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.568 -0.707 . . . . 0.0 110.308 -178.658 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.9 t80 -32.87 -38.94 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.866 -0.521 . . . . 0.0 112.224 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.768 HG13 HD13 ' A' ' 20' ' ' ILE . 43.9 mm -55.89 -66.31 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 120.954 -1.091 . . . . 0.0 110.175 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.545 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 13.9 mmm -76.53 -35.93 58.0 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.36 -0.837 . . . . 0.0 110.259 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.681 ' HA ' HD12 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -60.14 -52.68 64.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.432 -0.792 . . . . 0.0 110.458 -179.752 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -58.49 -29.7 66.44 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.304 -0.872 . . . . 0.0 110.248 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.5 mtt -69.8 -42.5 73.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.271 -0.893 . . . . 0.0 110.294 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 27' ' ' ASP . 59.2 mt -55.16 -50.24 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.258 -0.901 . . . . 0.0 110.196 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.1 m -74.34 -14.97 60.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.409 -0.807 . . . . 0.0 110.301 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.28 -31.2 65.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.268 -0.895 . . . . 0.0 110.45 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 147.47 -20.03 1.51 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.972 -1.251 . . . . 0.0 109.972 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -57.15 -51.65 68.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.163 -1.198 . . . . 0.0 110.203 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mp -132.12 155.48 48.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.367 -0.833 . . . . 0.0 110.115 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.4 p -57.48 160.22 4.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.414 -0.804 . . . . 0.0 110.324 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.2 mt -71.19 -15.31 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.372 -0.83 . . . . 0.0 110.322 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.3 m -56.18 -26.17 49.64 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.276 -0.89 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -66.55 -34.03 77.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.321 -0.862 . . . . 0.0 110.219 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -68.46 -37.11 79.9 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.315 -0.865 . . . . 0.0 110.174 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.21 -33.82 76.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.428 -0.795 . . . . 0.0 110.1 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -75.99 -60.56 2.27 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.354 -0.841 . . . . 0.0 110.1 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.513 HG21 HD12 ' A' ' 56' ' ' LEU . 80.4 t -48.53 -33.6 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.491 -0.755 . . . . 0.0 110.546 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -43.8 -48.71 8.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.643 -0.661 . . . . 0.0 111.403 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -145.26 14.36 1.45 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.118 -0.989 . . . . 0.0 111.235 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.631 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.1 tp10 -80.17 -47.84 1.33 Allowed Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.032 -1.042 . . . . 0.0 110.962 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -75.99 170.25 20.49 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.154 1.081 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.7 m -145.86 -45.41 0.21 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.362 -0.836 . . . . 0.0 110.289 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -91.51 -166.87 1.66 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.378 -0.826 . . . . 0.0 110.305 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -17.78 45.29 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.359 -0.838 . . . . 0.0 110.498 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -57.04 -18.89 15.88 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.253 -0.905 . . . . 0.0 110.556 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -49.53 -60.86 2.47 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.353 -0.842 . . . . 0.0 110.579 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.536 ' HB2' HG23 ' A' ' 22' ' ' THR . . . -74.14 -52.57 12.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.152 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.97 -34.21 5.35 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.385 -0.822 . . . . 0.0 110.622 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.6 ttp -82.95 -25.56 32.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.513 HD12 HG21 ' A' ' 43' ' ' VAL . 6.6 tt -81.45 -35.69 30.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.345 -0.847 . . . . 0.0 110.342 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.545 ' CD1' ' HE3' ' A' ' 26' ' ' MET . 41.7 mm -64.21 -43.15 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.244 -0.91 . . . . 0.0 109.934 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -61.06 -41.1 95.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.345 -0.847 . . . . 0.0 109.915 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.1 mtp -56.23 -33.33 65.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.303 -0.873 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.471 HD12 ' HA ' ' A' ' 57' ' ' ILE . 91.6 mt -61.19 -53.72 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.241 -0.912 . . . . 0.0 109.985 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.641 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.0 mm? -76.76 -30.22 56.45 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.473 -0.767 . . . . 0.0 110.506 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -26.62 66.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.302 -0.874 . . . . 0.0 110.221 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -64.99 1.03 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.356 -0.84 . . . . 0.0 110.166 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -159.93 155.74 26.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.401 -0.812 . . . . 0.0 110.219 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -77.23 -23.9 51.3 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.357 -0.84 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.08 -29.65 68.72 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.377 -0.827 . . . . 0.0 110.283 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 12.2 t -68.93 -34.91 76.14 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.304 -0.873 . . . . 0.0 110.053 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.821 ' CE1' HD23 ' A' ' 9' ' ' LEU . 19.9 t80 -62.45 -34.6 77.13 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.452 -0.78 . . . . 0.0 110.01 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.89 -40.85 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.41 -0.807 . . . . 0.0 110.033 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -69.42 -34.69 74.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.306 -0.871 . . . . 0.0 110.086 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.598 ' CE1' HD11 ' A' ' 75' ' ' LEU . 32.6 t80 -53.14 -35.48 59.78 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.054 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.882 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 47.6 t80 -70.68 -44.6 66.69 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.333 -0.854 . . . . 0.0 110.198 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -73.26 -27.88 61.82 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.37 -0.831 . . . . 0.0 110.479 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -48.9 65.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.294 -0.879 . . . . 0.0 110.384 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.604 HD13 HD12 ' A' ' 83' ' ' LEU . 14.9 mt -66.46 -44.61 82.31 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.333 -0.855 . . . . 0.0 110.351 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.632 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 35.1 mt -65.32 -15.03 62.11 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 110.544 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 46.7 t-80 -63.33 -24.46 67.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.204 -0.935 . . . . 0.0 110.632 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -112.03 -75.24 0.61 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.206 -0.933 . . . . 0.0 110.543 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -170.8 66.19 0.15 Allowed Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.582 ' CE1' HD11 ' A' ' 20' ' ' ILE . 20.0 m-85 -125.09 16.37 8.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -1.039 . . . . 0.0 110.481 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -43.14 -31.3 0.56 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.914 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.6 -42.08 59.31 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.387 -0.82 . . . . 0.0 109.779 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -73.24 -44.57 59.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.48 -0.763 . . . . 0.0 109.848 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.882 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.34 -33.55 73.81 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.391 -0.818 . . . . 0.0 110.043 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.42 -36.44 82.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 110.113 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.8 tt -60.12 -56.96 15.26 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.421 -0.8 . . . . 0.0 110.23 179.91 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.6 mp -69.24 -35.69 76.39 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.906 . . . . 0.0 110.072 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.698 ' HA ' HD12 ' A' ' 91' ' ' ILE . 49.1 t60 -62.15 -37.57 85.71 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -65.96 -17.56 64.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.426 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -102.57 -2.11 50.1 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.698 HD12 ' HA ' ' A' ' 88' ' ' HIS . 18.5 mt -72.04 -55.48 5.14 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.278 . . . . 0.0 110.34 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.562 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.1 Cg_endo -71.29 -89.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 O-C-N 123.265 1.139 . . . . 0.0 110.54 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.56 HG12 ' H ' ' A' ' 95' ' ' SER . 87.8 t -150.16 146.26 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.031 -1.043 . . . . 0.0 109.959 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.778 HG23 ' HE3' ' A' ' 4' ' ' LYS . 59.1 t -70.68 -32.35 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.348 -0.845 . . . . 0.0 110.027 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.56 ' H ' HG12 ' A' ' 93' ' ' VAL . 32.2 t -70.24 -27.15 64.23 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 110.294 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 4.0 m -68.73 -65.64 0.68 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.311 -0.868 . . . . 0.0 110.169 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.207 -179.933 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 mtp . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.162 0.506 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -80.99 149.12 29.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.398 -0.814 . . . . 0.0 110.3 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -73.08 -24.8 60.71 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.388 -0.82 . . . . 0.0 110.312 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -56.19 -39.5 72.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.32 -0.863 . . . . 0.0 110.458 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.414 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -62.09 -36.98 83.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.287 -0.883 . . . . 0.0 110.188 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.505 ' HG3' HD12 ' A' ' 61' ' ' LEU . 42.6 ttp180 -72.01 -44.09 63.99 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.89 -25.21 67.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.296 -0.877 . . . . 0.0 110.238 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.75 -57.59 10.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.338 -0.851 . . . . 0.0 110.141 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.731 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.8 OUTLIER -56.4 -34.75 67.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.315 -0.866 . . . . 0.0 110.131 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 90.9 mt -80.6 -20.34 43.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.35 -0.844 . . . . 0.0 110.429 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -110.53 31.49 5.92 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -0.856 . . . . 0.0 110.381 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.448 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 4.5 t-160 -142.41 45.0 1.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.351 -0.843 . . . . 0.0 109.987 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -75.09 -37.31 61.59 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.442 -0.786 . . . . 0.0 110.507 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.43 -35.47 65.44 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.175 -0.953 . . . . 0.0 110.595 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.448 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -85.59 -56.3 3.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.288 -0.882 . . . . 0.0 110.312 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.74 HD23 HG13 ' A' ' 57' ' ' ILE . 56.7 tp -55.85 -42.64 76.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.343 -0.848 . . . . 0.0 110.59 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -60.51 -49.29 78.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 0.0 110.079 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -72.19 -26.35 62.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.364 -0.835 . . . . 0.0 110.04 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -72.41 -58.65 3.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.85 . . . . 0.0 110.09 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.723 HD13 HG21 ' A' ' 25' ' ' ILE . 22.8 mt -135.59 109.86 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.366 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.567 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.8 mttt -79.45 142.67 35.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.556 -0.715 . . . . 0.0 109.558 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.567 ' C ' ' O ' ' A' ' 21' ' ' LYS . 61.6 p -23.75 97.34 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 CA-C-O 121.454 0.645 . . . . 0.0 111.09 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 24' ' ' TYR . 32.7 t -152.87 -176.52 5.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.712 -0.617 . . . . 0.0 110.222 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.446 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.7 t80 -33.0 -44.5 0.11 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.826 -0.546 . . . . 0.0 111.957 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.723 HG21 HD13 ' A' ' 20' ' ' ILE . 43.0 mm -54.74 -63.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.075 -1.016 . . . . 0.0 110.195 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.515 ' CE ' HD11 ' A' ' 16' ' ' LEU . 15.1 mtt -75.37 -39.03 59.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -59.79 -51.47 69.59 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.367 -0.833 . . . . 0.0 110.565 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -54.47 -36.1 63.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.268 -0.895 . . . . 0.0 110.337 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -32.19 73.5 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -0.825 . . . . 0.0 110.079 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.634 HD13 HD13 ' A' ' 35' ' ' LEU . 47.2 mm -60.78 -65.13 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.295 -0.878 . . . . 0.0 110.062 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -68.67 -18.62 64.31 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.395 -0.816 . . . . 0.0 110.551 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -24.44 25.89 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.184 -0.947 . . . . 0.0 110.374 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 -13.94 4.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.497 ' CB ' HD12 ' A' ' 35' ' ' LEU . 25.0 m-85 -69.62 -55.24 10.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -1.187 . . . . 0.0 110.454 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.634 HD13 HD13 ' A' ' 30' ' ' ILE . 4.6 mp -121.83 165.17 16.29 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.326 -0.859 . . . . 0.0 110.416 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.0 p -65.16 147.68 53.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 110.24 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.1 mt -73.14 -20.85 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.412 -0.805 . . . . 0.0 110.219 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 m -57.91 -36.79 72.95 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.228 -0.92 . . . . 0.0 110.356 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.453 ' O ' HG23 ' A' ' 43' ' ' VAL . 35.2 tt0 -63.61 -26.84 68.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.368 -0.833 . . . . 0.0 110.212 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -68.69 -45.31 72.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.327 -0.858 . . . . 0.0 110.136 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -63.13 -36.42 83.55 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.316 -0.865 . . . . 0.0 110.152 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -58.24 3.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.423 -0.798 . . . . 0.0 110.179 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 39' ' ' GLU . 68.9 t -50.83 -33.55 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.384 -0.823 . . . . 0.0 110.346 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -46.06 -32.4 2.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.509 -0.744 . . . . 0.0 111.468 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -145.42 21.7 1.51 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.01 -1.057 . . . . 0.0 111.309 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.442 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 0.3 OUTLIER -85.87 -54.53 0.41 Allowed Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.091 -1.006 . . . . 0.0 110.767 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 46' ' ' GLU . 49.9 Cg_endo -77.22 163.87 29.84 Favored 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.456 1.24 . . . . 0.0 110.614 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.9 m -137.4 -42.96 0.55 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.348 -0.845 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.26 -161.25 0.57 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.056 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -15.07 56.17 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.299 -0.875 . . . . 0.0 110.636 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 52.6 tt0 -55.98 -20.16 15.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.193 -0.942 . . . . 0.0 110.664 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.489 ' HG2' HG21 ' A' ' 22' ' ' THR . 25.7 ttm180 -51.45 -54.82 23.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.168 -0.958 . . . . 0.0 110.606 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.36 -29.2 34.15 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.331 -0.856 . . . . 0.0 110.188 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.59 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -62.45 -32.16 72.99 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.257 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 4.9 ttt -80.63 -48.16 13.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.427 -0.795 . . . . 0.0 110.31 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 26' ' ' MET . 23.4 tp -58.68 -36.36 74.07 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.379 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.74 HG13 HD23 ' A' ' 16' ' ' LEU . 0.2 OUTLIER -61.6 -44.47 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.434 -0.791 . . . . 0.0 109.672 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -70.28 -36.77 74.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.47 -0.769 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.404 ' O ' HD21 ' A' ' 35' ' ' LEU . 21.4 mmt -59.52 -36.53 76.3 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.339 -0.851 . . . . 0.0 110.367 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 57' ' ' ILE . 77.0 mt -60.67 -58.56 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.452 -0.78 . . . . 0.0 110.239 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.505 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.43 -40.28 77.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.572 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -59.08 -31.17 68.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.302 -0.874 . . . . 0.0 110.411 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -65.09 0.73 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.319 -0.863 . . . . 0.0 110.183 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -160.16 158.62 30.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.288 -0.882 . . . . 0.0 110.213 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -81.84 -26.86 33.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.456 -0.777 . . . . 0.0 110.194 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.52 -34.25 77.38 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.294 -0.879 . . . . 0.0 110.261 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.3 t -65.15 -36.89 85.65 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.353 -0.842 . . . . 0.0 110.155 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.625 ' HE1' HD23 ' A' ' 9' ' ' LEU . 18.9 t80 -59.25 -36.62 75.82 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.39 -0.819 . . . . 0.0 110.105 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.75 -46.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.361 -0.837 . . . . 0.0 109.986 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.5 t -62.02 -33.97 75.34 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.304 -0.873 . . . . 0.0 109.999 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.796 ' CE1' HD11 ' A' ' 75' ' ' LEU . 3.3 t80 -57.74 -36.67 72.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.35 -0.844 . . . . 0.0 109.787 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 34.6 t80 -62.74 -41.86 99.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.496 -0.752 . . . . 0.0 109.941 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.81 -27.35 40.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.4 -0.813 . . . . 0.0 110.225 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.37 -47.79 84.56 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.325 -0.86 . . . . 0.0 110.192 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.796 HD11 ' CE1' ' A' ' 71' ' ' PHE . 7.8 mt -66.78 -41.17 88.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.328 -0.857 . . . . 0.0 110.224 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.423 HD21 ' HB3' ' A' ' 84' ' ' ALA . 43.6 mt -66.68 -15.11 63.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.421 -0.799 . . . . 0.0 110.57 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -61.96 -22.41 65.62 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.191 -0.943 . . . . 0.0 110.549 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -112.53 -75.15 0.61 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.22 -0.925 . . . . 0.0 110.426 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.97 36.9 0.11 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -93.78 16.44 14.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.458 -1.025 . . . . 0.0 110.49 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -42.19 -31.33 0.37 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.522 -0.736 . . . . 0.0 110.906 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -67.52 -48.1 68.01 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.356 -0.84 . . . . 0.0 109.703 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.659 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -78.09 -44.02 27.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.508 -0.745 . . . . 0.0 109.827 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.423 ' HB3' HD21 ' A' ' 76' ' ' LEU . . . -59.15 -43.47 92.06 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.349 -0.844 . . . . 0.0 110.238 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.03 -29.72 70.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.35 -0.844 . . . . 0.0 110.11 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.7 tp -57.43 -46.09 83.93 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.355 -0.841 . . . . 0.0 110.309 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mp -73.97 -33.42 63.86 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.856 ' HA ' HD12 ' A' ' 91' ' ' ILE . 13.3 t-160 -58.91 -25.77 63.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.348 -0.845 . . . . 0.0 110.386 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -85.04 -18.85 33.09 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.335 -0.853 . . . . 0.0 110.451 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -97.08 -26.98 9.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.856 HD12 ' HA ' ' A' ' 88' ' ' HIS . 42.9 mt -56.87 -47.88 98.3 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.352 -1.087 . . . . 0.0 110.977 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo -70.44 -89.76 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.225 0 O-C-N 123.223 1.117 . . . . 0.0 110.72 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.45 HG23 ' C ' ' A' ' 92' ' ' PRO . 60.7 t -147.82 145.42 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 120.897 -1.127 . . . . 0.0 110.268 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.4 t -122.33 -26.93 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.413 -0.804 . . . . 0.0 110.375 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 31.4 t -56.75 -73.5 0.06 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.229 -0.92 . . . . 0.0 110.547 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.6 t -100.48 -71.05 0.72 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.324 -0.86 . . . . 0.0 110.338 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.215 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 ttt . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.247 0.546 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -92.77 129.11 38.8 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.369 -0.832 . . . . 0.0 110.292 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.74 -24.69 67.82 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.409 -0.807 . . . . 0.0 110.263 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -29.35 61.14 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.329 -0.857 . . . . 0.0 110.575 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.69 -38.04 88.84 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.235 -0.915 . . . . 0.0 110.223 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -68.1 -28.51 67.4 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.206 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -79.44 -27.21 41.68 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.351 -0.843 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.62 -51.0 70.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.474 -0.766 . . . . 0.0 110.165 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.731 ' O ' HD13 ' A' ' 9' ' ' LEU . 3.0 tm? -62.53 -36.77 83.64 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.369 -0.832 . . . . 0.0 109.752 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.47 -27.53 62.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.319 -0.863 . . . . 0.0 110.137 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -98.07 27.47 4.55 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.285 -0.884 . . . . 0.0 110.121 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.725 ' ND1' ' HB3' ' A' ' 15' ' ' ALA . 1.9 t-80 -124.22 26.92 7.27 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.468 -0.77 . . . . 0.0 109.9 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -75.68 -36.58 60.03 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.286 -0.884 . . . . 0.0 110.475 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -68.36 -36.0 78.55 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.295 -0.878 . . . . 0.0 110.617 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.725 ' HB3' ' ND1' ' A' ' 12' ' ' HIS . . . -85.05 -30.28 24.24 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.361 -0.837 . . . . 0.0 110.027 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.405 ' CD2' ' CG1' ' A' ' 57' ' ' ILE . 1.3 tp -80.72 -44.03 19.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.395 -0.815 . . . . 0.0 110.032 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -59.16 -35.66 73.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.385 -0.822 . . . . 0.0 110.071 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -78.2 -41.78 33.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.38 -0.825 . . . . 0.0 110.285 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.24 -65.28 1.03 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.241 -0.912 . . . . 0.0 110.514 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.645 HD12 HG21 ' A' ' 25' ' ' ILE . 12.8 mm -94.95 109.69 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.544 ' O ' ' C ' ' A' ' 22' ' ' THR . 2.7 mtpm? -103.28 141.3 36.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.59 -0.694 . . . . 0.0 109.284 179.15 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.692 HG21 ' HD3' ' A' ' 52' ' ' ARG . 73.4 p -24.68 98.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.677 -0.64 . . . . 0.0 110.987 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.438 ' O ' ' C ' ' A' ' 24' ' ' TYR . 81.4 p -159.97 -176.58 5.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.559 -0.713 . . . . 0.0 110.377 -178.628 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.438 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.7 t80 -33.55 -39.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.86 -0.525 . . . . 0.0 111.939 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.645 HG21 HD12 ' A' ' 20' ' ' ILE . 44.8 mm -57.23 -65.69 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.029 -1.044 . . . . 0.0 109.997 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.437 ' SD ' HD11 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -76.11 -40.87 51.94 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 110.189 179.711 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -55.02 -60.02 3.95 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.363 -0.835 . . . . 0.0 110.717 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -56.73 -38.82 72.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.35 -0.844 . . . . 0.0 110.457 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.557 ' HE3' HG23 ' A' ' 60' ' ' ILE . 4.5 ttp -62.99 -28.11 69.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.377 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.557 HG23 ' HB2' ' A' ' 35' ' ' LEU . 27.2 mt -83.85 -34.55 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.259 -0.9 . . . . 0.0 110.29 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -87.26 -18.73 29.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.294 -0.879 . . . . 0.0 110.512 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -57.58 -23.7 52.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.238 -0.914 . . . . 0.0 110.38 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 141.23 -17.13 2.72 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.821 -1.311 . . . . 0.0 109.821 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.64 ' C ' HD22 ' A' ' 35' ' ' LEU . 7.1 m-30 -53.84 -66.6 0.36 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.237 -1.154 . . . . 0.0 110.333 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.64 HD22 ' C ' ' A' ' 34' ' ' PHE . 4.0 mm? -106.44 165.15 11.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.488 -0.757 . . . . 0.0 110.058 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.3 p -59.59 169.34 1.34 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.432 -0.792 . . . . 0.0 110.273 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.8 mt -84.68 -24.45 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.384 -0.823 . . . . 0.0 110.158 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.4 m -58.91 -24.53 62.47 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.348 -0.845 . . . . 0.0 110.365 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -60.67 -35.88 77.35 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.31 -0.869 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.45 -36.34 80.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.75 -27.04 63.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.341 -0.849 . . . . 0.0 110.096 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 ttmt -82.95 -61.75 1.78 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.378 -0.826 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 61.7 t -48.05 -33.75 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.585 -0.697 . . . . 0.0 110.838 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttm-85 -45.98 -47.22 16.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.486 -0.759 . . . . 0.0 111.279 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -144.99 23.82 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.147 -0.971 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.611 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 1.1 tm-20 -81.82 -48.91 0.95 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.863 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.2 Cg_endo -75.99 169.88 21.23 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.127 1.067 . . . . 0.0 110.526 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.4 m -136.69 -41.97 0.61 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.404 -0.81 . . . . 0.0 110.139 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -100.2 -152.88 0.43 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.009 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.21 -7.65 48.23 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.222 -0.924 . . . . 0.0 110.66 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -55.72 -21.28 17.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.108 -0.995 . . . . 0.0 110.663 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.692 ' HD3' HG21 ' A' ' 22' ' ' THR . 20.3 ttm180 -52.76 -32.46 43.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.25 -0.906 . . . . 0.0 110.557 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.491 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -91.57 -11.67 36.6 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.299 -0.876 . . . . 0.0 110.524 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.65 -42.76 14.02 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.077 -1.014 . . . . 0.0 110.244 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -43.02 24.17 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.312 -0.867 . . . . 0.0 110.219 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.506 HD22 HG22 ' A' ' 22' ' ' THR . 18.2 tp -60.15 -38.73 84.02 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.245 -0.91 . . . . 0.0 110.125 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.573 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.2 mp -76.51 -34.33 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.368 -0.833 . . . . 0.0 109.684 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -68.06 -38.11 82.06 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.323 -0.861 . . . . 0.0 109.641 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 mtt -59.88 -35.02 73.95 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.029 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.557 HG23 ' HE3' ' A' ' 29' ' ' MET . 95.8 mt -58.27 -52.33 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.396 -0.815 . . . . 0.0 110.036 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -75.18 -22.19 58.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.39 -0.819 . . . . 0.0 110.763 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.51 -27.36 63.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.252 -0.905 . . . . 0.0 110.585 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HB2' HD11 ' A' ' 35' ' ' LEU . 47.5 tptt -70.8 -65.17 0.77 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.263 -0.898 . . . . 0.0 110.208 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -160.11 155.51 25.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.404 -0.81 . . . . 0.0 110.275 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.8 -28.19 65.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.464 -0.773 . . . . 0.0 110.125 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -62.41 -37.1 84.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.465 -0.772 . . . . 0.0 110.213 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.1 t -60.93 -33.22 72.82 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.294 -0.879 . . . . 0.0 110.174 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.64 ' HE1' HD23 ' A' ' 9' ' ' LEU . 15.6 t80 -64.86 -39.93 94.34 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.464 -0.772 . . . . 0.0 110.118 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.45 -31.79 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.335 -0.853 . . . . 0.0 110.074 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.6 t -70.61 -38.93 74.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.353 -0.842 . . . . 0.0 109.984 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.575 ' CE2' HD22 ' A' ' 87' ' ' LEU . 5.0 t80 -54.82 -38.19 67.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.385 -0.822 . . . . 0.0 109.818 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.703 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.0 t80 -65.08 -46.87 79.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.377 -0.827 . . . . 0.0 109.941 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.446 ' HA ' HD12 ' A' ' 76' ' ' LEU . 4.0 t30 -72.02 -25.95 62.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.369 -0.832 . . . . 0.0 110.42 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.32 -45.03 74.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 110.178 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.544 HD11 ' CE1' ' A' ' 71' ' ' PHE . 28.5 mt -68.56 -38.17 80.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.325 -0.859 . . . . 0.0 110.353 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.703 HD11 ' CE1' ' A' ' 72' ' ' TYR . 22.6 mt -66.38 -15.17 63.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.349 -0.844 . . . . 0.0 110.576 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -63.04 -22.81 67.11 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.214 -0.929 . . . . 0.0 110.549 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.49 -75.46 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.212 -0.93 . . . . 0.0 110.407 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.2 35.94 0.1 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -95.28 16.2 17.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.995 . . . . 0.0 110.449 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 11.9 ttpt -46.48 -30.58 2.26 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.392 -0.817 . . . . 0.0 110.973 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -62.09 -60.92 2.9 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.285 -0.884 . . . . 0.0 109.821 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 83' ' ' LEU . 5.5 tt -71.28 -43.8 66.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.442 -0.786 . . . . 0.0 109.992 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.27 -40.53 71.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.444 -0.785 . . . . 0.0 110.305 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.57 -35.17 75.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.599 HD23 ' CE1' ' A' ' 12' ' ' HIS . 19.3 tp -61.69 -28.24 69.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.369 -0.832 . . . . 0.0 110.271 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 71' ' ' PHE . 0.6 OUTLIER -84.62 -39.52 18.58 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.31 -0.869 . . . . 0.0 110.429 -179.935 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.846 ' HA ' HD12 ' A' ' 91' ' ' ILE . 48.5 t-80 -67.36 -47.8 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -69.59 -15.07 63.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.349 -0.844 . . . . 0.0 110.562 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -91.37 -16.38 53.23 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 88' ' ' HIS . 18.7 mt -66.54 -53.77 27.56 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.159 -1.201 . . . . 0.0 110.436 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.576 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo -71.84 -83.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 123.336 1.177 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.446 HG12 ' N ' ' A' ' 94' ' ' VAL . 59.8 t -127.29 164.49 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.093 -1.005 . . . . 0.0 110.161 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.446 ' N ' HG12 ' A' ' 93' ' ' VAL . 57.6 t -91.82 -62.9 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.445 -0.784 . . . . 0.0 110.17 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.7 t -164.83 -55.74 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.312 -0.868 . . . . 0.0 110.266 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.4 m -114.44 -65.08 1.23 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.287 -0.883 . . . . 0.0 110.23 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.2 m . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.236 -179.97 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.161 0.505 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -143.91 142.59 30.86 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.355 -0.841 . . . . 0.0 110.248 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.38 -25.46 68.03 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.451 -0.78 . . . . 0.0 110.272 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -58.17 -50.46 73.46 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.317 -0.865 . . . . 0.0 110.269 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.708 ' CB ' HG23 ' A' ' 91' ' ' ILE . . . -61.21 -35.65 77.77 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.286 -0.884 . . . . 0.0 109.786 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HG3' HD12 ' A' ' 61' ' ' LEU . 23.0 ttm-85 -68.42 -36.01 78.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.393 -0.817 . . . . 0.0 109.79 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -65.5 -32.86 74.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.473 -0.767 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.4 t -57.57 -59.83 4.58 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.312 -0.868 . . . . 0.0 110.082 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.938 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.4 tm? -59.33 -34.85 72.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.349 -0.844 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.5 mt -73.62 -28.0 61.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.367 -0.833 . . . . 0.0 110.054 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -93.66 1.98 56.45 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.42 -0.8 . . . . 0.0 110.567 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.439 ' ND1' ' HB3' ' A' ' 15' ' ' ALA . 43.5 t-80 -98.15 28.99 3.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.155 -0.966 . . . . 0.0 109.696 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -71.01 -55.25 8.68 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.304 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.41 -34.58 75.6 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.439 ' HB3' ' ND1' ' A' ' 12' ' ' HIS . . . -74.2 -34.72 63.81 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.293 -0.879 . . . . 0.0 110.133 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.66 HD13 HG13 ' A' ' 57' ' ' ILE . 8.3 tt -77.16 -40.81 44.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.464 -0.773 . . . . 0.0 110.39 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.8 -41.88 62.04 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.28 -0.888 . . . . 0.0 110.405 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.6 ttpt -85.5 -32.0 22.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.343 -0.848 . . . . 0.0 110.548 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.627 ' HB3' HD11 ' A' ' 83' ' ' LEU . 70.6 m-20 -85.18 -65.53 1.0 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.879 . . . . 0.0 111.01 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 25' ' ' ILE . 13.4 mm -114.58 122.33 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.23 -0.919 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.553 ' O ' ' C ' ' A' ' 22' ' ' THR . 19.2 mtmm -113.75 141.89 46.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.631 -0.668 . . . . 0.0 109.23 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.809 HG22 HD22 ' A' ' 56' ' ' LEU . 74.0 p -24.1 97.53 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.652 -0.655 . . . . 0.0 111.149 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 24' ' ' TYR . 34.9 t -160.63 -176.75 5.74 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.487 -0.758 . . . . 0.0 110.557 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 23' ' ' SER . 8.1 t80 -33.57 -46.67 0.2 Allowed 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.899 -0.501 . . . . 0.0 112.168 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.473 HG21 HD12 ' A' ' 20' ' ' ILE . 38.6 mm -49.91 -64.67 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.06 -1.025 . . . . 0.0 110.527 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.586 ' HE2' HD11 ' A' ' 16' ' ' LEU . 4.5 mmt -72.75 -53.5 11.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.345 -0.847 . . . . 0.0 110.367 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -46.64 -43.92 17.93 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.51 -0.744 . . . . 0.0 111.067 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 58.0 t60 -59.64 -37.35 78.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.119 -0.988 . . . . 0.0 109.846 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 29.9 mmt -80.26 -28.23 38.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.419 -0.801 . . . . 0.0 110.199 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.711 HG21 ' OE1' ' A' ' 40' ' ' GLU . 29.4 mm -64.41 -50.45 76.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.351 -0.843 . . . . 0.0 109.937 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.0 m -75.71 -19.74 58.87 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.348 -0.845 . . . . 0.0 110.483 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -24.07 47.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.164 -0.96 . . . . 0.0 110.358 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.47 -17.52 2.06 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.637 ' C ' HD22 ' A' ' 35' ' ' LEU . 12.6 m-30 -56.23 -72.33 0.08 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.217 -1.166 . . . . 0.0 110.451 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.637 HD22 ' C ' ' A' ' 34' ' ' PHE . 4.0 mm? -106.47 161.82 14.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.293 -0.879 . . . . 0.0 110.227 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 p -70.67 162.5 28.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.403 -0.811 . . . . 0.0 110.095 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.0 mt -79.25 -29.13 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.287 -0.883 . . . . 0.0 110.06 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -61.97 -33.16 73.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.405 -0.809 . . . . 0.0 110.171 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.711 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.5 tt0 -75.02 -26.74 59.71 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 110.316 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.711 ' OE1' HG21 ' A' ' 30' ' ' ILE . 9.1 tp10 -74.0 -39.02 63.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.288 -0.882 . . . . 0.0 110.313 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -62.13 -35.93 80.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.296 -0.878 . . . . 0.0 110.261 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' O ' ' N ' ' A' ' 46' ' ' GLU . 16.0 tttt -72.29 -41.89 66.14 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.201 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.711 HG23 ' O ' ' A' ' 39' ' ' GLU . 98.9 t -58.26 -34.47 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.344 -0.848 . . . . 0.0 110.38 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -55.87 -24.78 38.98 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.333 -0.854 . . . . 0.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -142.69 15.4 1.96 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.128 -0.982 . . . . 0.0 111.073 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.629 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 34.1 tt0 -81.85 -51.19 0.83 Allowed Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.017 -1.052 . . . . 0.0 110.585 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.629 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -76.61 170.2 20.37 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.201 1.106 . . . . 0.0 110.404 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.3 m -124.71 -39.04 2.32 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.36 -0.837 . . . . 0.0 110.274 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -104.31 -153.48 0.48 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.307 -0.871 . . . . 0.0 110.053 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -8.73 51.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.211 -0.931 . . . . 0.0 110.656 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -52.06 -24.97 7.56 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.114 -0.991 . . . . 0.0 110.65 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HG2' HG21 ' A' ' 22' ' ' THR . 24.2 ttp180 -52.95 -25.26 11.37 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.246 -0.909 . . . . 0.0 110.544 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.445 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -86.96 -26.32 23.89 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.309 -0.87 . . . . 0.0 110.315 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.82 -29.41 50.64 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 110.373 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.3 ttt -79.16 -52.47 8.13 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.304 -0.872 . . . . 0.0 110.481 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.809 HD22 HG22 ' A' ' 22' ' ' THR . 32.1 tp -51.08 -35.06 33.03 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.375 -0.828 . . . . 0.0 110.95 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.705 ' HA ' HD12 ' A' ' 60' ' ' ILE . 0.8 OUTLIER -72.78 -32.19 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.219 -0.926 . . . . 0.0 110.265 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -70.87 -35.63 72.47 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 110.348 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.467 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -65.04 -29.49 70.39 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.229 -0.919 . . . . 0.0 110.141 179.672 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.705 HD12 ' HA ' ' A' ' 57' ' ' ILE . 96.6 mt -62.74 -53.55 45.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.886 . . . . 0.0 109.684 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.571 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.1 mm? -73.67 -37.22 65.34 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt -60.34 -27.55 67.45 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.336 -0.853 . . . . 0.0 110.524 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -78.67 -64.66 1.12 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.154 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -160.2 153.89 22.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.351 -0.843 . . . . 0.0 110.207 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -74.96 -24.13 58.41 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.32 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -36.82 83.0 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.313 -0.867 . . . . 0.0 110.114 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.8 t -61.66 -31.47 71.59 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.468 -0.77 . . . . 0.0 110.061 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.938 ' CE1' HD23 ' A' ' 9' ' ' LEU . 8.7 t80 -68.2 -38.53 82.06 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.323 -0.861 . . . . 0.0 110.008 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.7 -42.54 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.345 -0.847 . . . . 0.0 110.105 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.8 t -62.96 -39.13 93.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.88 . . . . 0.0 109.938 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.72 ' CE2' HD11 ' A' ' 75' ' ' LEU . 1.8 t80 -53.25 -36.62 61.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.469 -0.77 . . . . 0.0 109.824 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.687 ' CE1' HD11 ' A' ' 76' ' ' LEU . 31.3 t80 -63.53 -45.91 88.39 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.308 -0.87 . . . . 0.0 110.075 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 0.459 ' HA ' HD12 ' A' ' 76' ' ' LEU . 5.5 t30 -75.98 -23.07 55.28 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.308 -0.87 . . . . 0.0 110.583 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.11 -33.99 75.53 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.176 -0.952 . . . . 0.0 110.403 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.72 HD11 ' CE2' ' A' ' 71' ' ' PHE . 4.3 mt -84.79 -33.69 22.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.34 -0.85 . . . . 0.0 110.432 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.708 HD21 ' CB ' ' A' ' 84' ' ' ALA . 26.6 mt -67.65 -14.93 63.37 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.375 -0.828 . . . . 0.0 110.584 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -66.51 -24.45 66.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.158 -0.964 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -103.26 -75.1 0.62 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.219 -0.926 . . . . 0.0 110.504 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.85 48.3 0.15 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -106.27 16.16 25.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.435 -1.038 . . . . 0.0 110.495 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -46.14 -32.74 3.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.387 -0.82 . . . . 0.0 110.735 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -68.63 -63.59 1.03 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 109.856 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.724 HD23 ' O ' ' A' ' 83' ' ' LEU . 4.7 tt -62.79 -36.43 83.11 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.89 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.708 ' CB ' HD21 ' A' ' 76' ' ' LEU . . . -59.95 -36.69 77.62 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.469 -0.769 . . . . 0.0 110.044 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.23 -34.27 74.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.455 -0.778 . . . . 0.0 110.07 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.89 -47.48 84.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.451 -0.781 . . . . 0.0 109.926 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.41 ' O ' HD12 ' A' ' 91' ' ' ILE . 0.9 OUTLIER -72.1 -39.96 68.53 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.36 -0.838 . . . . 0.0 110.174 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.653 ' HA ' HD12 ' A' ' 91' ' ' ILE . 27.5 t-80 -62.42 -55.54 26.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.38 -0.825 . . . . 0.0 110.173 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.5 -24.78 61.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.806 . . . . 0.0 110.302 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -75.04 -14.44 81.81 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.708 HG23 ' CB ' ' A' ' 5' ' ' ALA . 7.9 mt -72.84 -57.64 3.02 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.211 -1.17 . . . . 0.0 110.328 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.591 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 47.1 Cg_endo -72.73 -30.97 11.06 Favored 'Trans proline' 0 C--N 1.314 -1.274 0 O-C-N 123.29 1.153 . . . . 0.0 110.467 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.61 141.41 27.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.329 -0.857 . . . . 0.0 110.104 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.9 t -71.67 -78.41 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.47 -0.769 . . . . 0.0 110.246 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.8 t -137.41 5.33 2.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.257 -0.902 . . . . 0.0 110.822 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 40.4 t -58.03 -28.47 64.5 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.063 -1.023 . . . . 0.0 110.419 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.119 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.253 0.549 . . . . 0.0 110.141 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 2' ' ' ASP . 39.0 p-10 -86.75 100.03 12.2 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.339 -0.851 . . . . 0.0 110.364 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.14 -45.85 38.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.255 -0.903 . . . . 0.0 110.227 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -59.44 -37.44 78.12 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.399 -0.813 . . . . 0.0 110.212 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.21 -38.21 79.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.276 -0.89 . . . . 0.0 109.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.658 ' HG3' HD12 ' A' ' 61' ' ' LEU . 47.2 ttt180 -64.64 -31.93 73.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.381 -0.824 . . . . 0.0 109.778 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 25.7 m-80 -75.68 -27.79 58.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.431 -0.793 . . . . 0.0 110.028 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.9 t -61.83 -60.44 3.64 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.319 -0.863 . . . . 0.0 110.168 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.748 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.8 OUTLIER -53.33 -34.89 59.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.359 -0.838 . . . . 0.0 110.105 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 48.9 mt -79.97 -26.22 40.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.355 -0.84 . . . . 0.0 110.273 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -110.15 33.25 4.56 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.407 -0.808 . . . . 0.0 110.337 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.439 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.6 t-160 -146.39 43.54 1.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.331 -0.855 . . . . 0.0 110.081 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.3 ttp85 -75.36 -31.5 60.55 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.443 -0.786 . . . . 0.0 110.297 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.07 -34.43 70.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.225 -0.922 . . . . 0.0 110.402 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.439 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -84.93 -42.43 14.98 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.094 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.703 HD22 HG12 ' A' ' 57' ' ' ILE . 9.2 tt -63.1 -37.37 86.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.385 -0.822 . . . . 0.0 110.19 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -76.09 -32.07 59.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.79 . . . . 0.0 110.073 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -64.78 -49.66 69.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.43 -0.794 . . . . 0.0 110.128 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -84.55 -55.72 3.98 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.381 -0.825 . . . . 0.0 110.066 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.655 HG21 ' CE ' ' A' ' 26' ' ' MET . 14.9 mm -98.95 158.19 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.292 -0.88 . . . . 0.0 109.995 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.561 ' O ' ' C ' ' A' ' 22' ' ' THR . 50.9 mttt -154.14 141.52 19.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.477 -0.765 . . . . 0.0 109.481 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.931 HG22 HD22 ' A' ' 56' ' ' LEU . 67.9 p -24.63 96.5 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 121.47 0.652 . . . . 0.0 110.893 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 42.7 m -163.36 -175.84 4.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.548 -0.72 . . . . 0.0 110.157 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 11.2 t80 -33.08 -37.26 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.894 -0.504 . . . . 0.0 112.092 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.607 HG13 HD12 ' A' ' 20' ' ' ILE . 46.2 mm -54.63 -65.78 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.047 -1.033 . . . . 0.0 109.994 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.655 ' CE ' HG21 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -76.43 -34.47 58.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.349 -0.844 . . . . 0.0 110.374 179.544 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -57.32 -41.88 80.8 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.364 -0.835 . . . . 0.0 110.553 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -75.01 -50.37 16.76 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.308 -0.87 . . . . 0.0 110.37 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 mpp? -60.02 -50.33 74.14 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.338 -0.851 . . . . 0.0 110.437 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.908 HG23 ' HB2' ' A' ' 35' ' ' LEU . 98.6 mt -61.35 -28.66 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.459 -0.776 . . . . 0.0 110.297 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.0 m -90.32 -23.0 21.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.353 -0.842 . . . . 0.0 110.354 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -59.72 -21.48 60.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.332 -0.855 . . . . 0.0 110.421 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.24 -16.59 2.1 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.656 ' C ' HD22 ' A' ' 35' ' ' LEU . 7.4 m-30 -53.15 -71.56 0.07 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.147 -1.208 . . . . 0.0 110.247 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.908 ' HB2' HG23 ' A' ' 30' ' ' ILE . 4.0 mm? -108.12 164.12 12.57 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 109.908 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 p -62.53 144.33 56.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.376 -0.827 . . . . 0.0 110.197 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.554 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.5 mp -69.53 -22.97 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.24 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -57.02 -27.88 62.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.297 -0.877 . . . . 0.0 110.316 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -62.34 -37.46 85.72 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.38 -0.825 . . . . 0.0 110.077 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.55 -33.11 72.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.412 -0.805 . . . . 0.0 110.201 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -69.0 -31.13 69.73 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.316 -0.865 . . . . 0.0 110.229 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HG2' ' CB ' ' A' ' 46' ' ' GLU . 1.6 ttmt -84.87 -59.47 2.34 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 110.377 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.442 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 88.7 t -48.5 -33.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.501 -0.749 . . . . 0.0 110.786 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -44.97 -45.43 10.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.554 -0.716 . . . . 0.0 111.421 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -144.49 15.2 1.62 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.092 -1.005 . . . . 0.0 111.125 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.623 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 3.0 tm-20 -79.94 -48.09 1.38 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.116 -0.99 . . . . 0.0 110.891 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.623 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -75.49 166.78 27.94 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.121 1.063 . . . . 0.0 110.522 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.3 m -136.44 -42.93 0.62 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.438 -0.789 . . . . 0.0 110.174 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -96.2 -159.23 0.71 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.35 -0.844 . . . . 0.0 110.129 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -64.06 -14.58 55.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.313 -0.867 . . . . 0.0 110.641 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -55.96 -19.96 14.39 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.271 -0.893 . . . . 0.0 110.721 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -49.69 -49.68 46.7 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.342 -0.849 . . . . 0.0 110.496 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.27 -42.98 53.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.396 -0.815 . . . . 0.0 110.323 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.43 -34.06 4.41 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.254 -0.904 . . . . 0.0 110.801 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 19.0 ttt -85.03 -24.75 28.05 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.306 -0.872 . . . . 0.0 110.019 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.931 HD22 HG22 ' A' ' 22' ' ' THR . 4.8 tp -82.01 -46.85 13.39 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.374 -0.828 . . . . 0.0 110.72 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.703 HG12 HD22 ' A' ' 16' ' ' LEU . 1.9 mp -68.63 -32.4 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.272 -0.893 . . . . 0.0 110.242 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp -71.04 -39.45 72.29 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.238 -0.914 . . . . 0.0 110.062 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.0 mmt -58.89 -29.24 66.87 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.355 -0.84 . . . . 0.0 110.338 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 57' ' ' ILE . 92.9 mt -67.08 -59.9 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.368 -0.833 . . . . 0.0 110.078 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.658 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.25 -38.75 78.61 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.447 -0.783 . . . . 0.0 110.483 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -59.87 -25.37 65.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.323 -0.861 . . . . 0.0 110.387 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.57 ' HB2' HD11 ' A' ' 35' ' ' LEU . 5.9 tptp -73.54 -65.43 0.82 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.44 169.95 21.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 110.376 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -83.9 -26.09 29.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.769 . . . . 0.0 110.14 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.01 -40.78 98.8 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.369 -0.832 . . . . 0.0 110.008 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.4 t -60.06 -33.28 71.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.29 -0.881 . . . . 0.0 110.12 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.618 ' HE1' HD23 ' A' ' 9' ' ' LEU . 26.7 t80 -65.73 -40.96 92.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.39 -0.819 . . . . 0.0 109.892 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.2 -41.38 83.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.387 -0.821 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.2 t -64.11 -32.7 74.36 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.351 -0.843 . . . . 0.0 110.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.645 ' CE1' HD11 ' A' ' 75' ' ' LEU . 7.8 t80 -57.97 -42.19 84.52 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.4 -0.813 . . . . 0.0 109.89 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.827 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 36.3 t80 -62.6 -37.95 88.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.389 -0.82 . . . . 0.0 110.251 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -76.96 -32.93 57.63 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.463 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.58 -30.48 71.35 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 110.247 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.649 HD23 ' CD2' ' A' ' 80' ' ' TYR . 6.4 mt -84.98 -39.63 17.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.404 -0.81 . . . . 0.0 110.339 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.827 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 24.1 mt -68.85 -15.51 63.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.343 -0.848 . . . . 0.0 110.601 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.9 -21.1 64.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.267 -0.896 . . . . 0.0 110.622 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -109.66 -75.34 0.63 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.176 -0.952 . . . . 0.0 110.499 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.15 35.5 0.1 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.649 ' CD2' HD23 ' A' ' 75' ' ' LEU . 17.5 m-85 -98.35 16.43 21.59 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.378 -1.072 . . . . 0.0 110.438 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 11.1 tttm -44.98 -29.79 0.9 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -0.784 . . . . 0.0 110.831 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -73.64 -45.16 54.45 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 109.794 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.0 tm? -78.88 -40.19 33.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.505 -0.747 . . . . 0.0 109.861 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.24 -31.23 72.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.379 -0.826 . . . . 0.0 110.097 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -68.8 -34.87 76.24 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.45 -0.781 . . . . 0.0 110.21 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.9 tp -60.0 -45.76 91.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.382 -0.824 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.441 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.2 mt -77.38 -24.59 50.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.349 -0.844 . . . . 0.0 110.441 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.518 ' HA ' HD12 ' A' ' 91' ' ' ILE . 81.9 t60 -79.11 -42.51 26.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.264 -0.897 . . . . 0.0 110.488 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -60.76 -19.92 60.23 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.309 -0.87 . . . . 0.0 110.494 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLY . . . . . 0.621 ' HA2' HG22 ' A' ' 94' ' ' VAL . . . -86.63 -19.26 56.94 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.61 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 78.7 mt -61.95 -51.14 77.43 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.187 -1.184 . . . . 0.0 110.728 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.61 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.6 Cg_endo -71.72 -85.17 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.211 0 O-C-N 123.116 1.061 . . . . 0.0 110.635 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.4 t -135.19 146.78 29.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.097 -1.002 . . . . 0.0 110.125 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.621 HG22 ' HA2' ' A' ' 90' ' ' GLY . 59.3 t -116.17 -26.69 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.37 -0.831 . . . . 0.0 110.224 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 39.6 t -59.84 -49.08 79.09 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.276 -0.89 . . . . 0.0 110.362 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 1.2 m -75.65 -54.95 6.15 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.337 -0.852 . . . . 0.0 110.185 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.0 t . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.195 179.999 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ttm . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.164 0.506 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -115.3 144.62 43.47 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 110.277 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.22 -25.0 59.41 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.403 -0.81 . . . . 0.0 110.295 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -60.25 -31.62 70.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.253 -0.904 . . . . 0.0 110.391 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.551 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -72.73 -39.3 67.0 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.351 -0.843 . . . . 0.0 110.07 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.714 ' HG3' HD12 ' A' ' 61' ' ' LEU . 11.7 ttt-85 -69.08 -26.28 64.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.514 -0.741 . . . . 0.0 110.187 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -76.08 -31.5 58.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.432 ' HB2' HG22 ' A' ' 94' ' ' VAL . 21.5 t -60.79 -56.3 22.81 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.371 -0.83 . . . . 0.0 110.173 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.71 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -55.31 -38.76 69.1 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.349 -0.844 . . . . 0.0 110.176 179.897 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.404 HD11 ' CZ ' ' A' ' 6' ' ' ARG . 84.8 mt -63.12 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.374 -0.829 . . . . 0.0 110.178 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -108.21 7.64 27.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.36 -0.837 . . . . 0.0 110.59 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.476 ' CE1' ' HG ' ' A' ' 86' ' ' LEU . 23.3 t-160 -103.86 32.35 3.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.171 -0.956 . . . . 0.0 109.92 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -75.06 -24.81 58.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.473 -0.767 . . . . 0.0 110.465 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -53.63 -35.74 61.28 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.194 -0.942 . . . . 0.0 110.379 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.83 -51.59 6.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.404 -0.81 . . . . 0.0 110.038 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.504 HD12 ' HB ' ' A' ' 20' ' ' ILE . 64.4 tp -57.44 -30.05 64.69 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 110.255 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -85.4 -33.16 22.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.435 -0.791 . . . . 0.0 110.371 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -67.5 -57.08 7.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.361 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -81.76 -65.2 1.04 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 110.391 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.504 ' HB ' HD12 ' A' ' 16' ' ' LEU . 14.8 mm -79.27 162.4 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.287 -0.883 . . . . 0.0 110.18 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.571 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.9 mttt -156.28 141.2 17.18 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.603 HG21 ' HG2' ' A' ' 52' ' ' ARG . 62.8 p -24.97 96.2 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.692 -0.63 . . . . 0.0 110.849 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.433 ' N ' ' O ' ' A' ' 21' ' ' LYS . 23.1 m -163.19 -175.96 4.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.617 -0.677 . . . . 0.0 110.304 -178.464 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.431 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.0 t80 -32.79 -40.56 0.05 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.831 -0.543 . . . . 0.0 112.176 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.637 ' CG2' HD21 ' A' ' 75' ' ' LEU . 41.5 mm -57.3 -65.71 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 120.918 -1.114 . . . . 0.0 110.029 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.461 ' HE3' HD23 ' A' ' 56' ' ' LEU . 10.5 mtm -75.86 -37.4 58.99 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.385 -0.822 . . . . 0.0 110.073 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 0.616 ' HA ' HD12 ' A' ' 30' ' ' ILE . 4.5 t70 -57.88 -50.54 73.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.428 -0.795 . . . . 0.0 110.358 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -55.59 -37.87 68.67 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.317 -0.864 . . . . 0.0 110.101 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.7 mtp -63.23 -38.43 91.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.409 -0.807 . . . . 0.0 110.131 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 27' ' ' ASP . 93.7 mt -61.87 -36.61 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.029 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.4 m -92.83 -19.78 21.37 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.301 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -56.22 -24.78 44.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.312 -0.868 . . . . 0.0 110.301 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.22 -12.34 3.82 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.674 ' C ' HD22 ' A' ' 35' ' ' LEU . 24.0 m-85 -67.53 -58.29 4.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.12 -1.224 . . . . 0.0 110.297 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.674 HD22 ' C ' ' A' ' 34' ' ' PHE . 3.9 mm? -109.58 165.14 11.89 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.326 -0.859 . . . . 0.0 110.225 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 42.8 p -65.14 163.56 14.77 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.079 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.1 mt -84.83 -27.87 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.284 -0.885 . . . . 0.0 110.177 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.5 m -62.35 -25.45 67.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.357 -0.839 . . . . 0.0 110.261 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.49 -29.31 65.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.833 . . . . 0.0 110.243 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.31 -53.89 52.19 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.326 -0.859 . . . . 0.0 110.25 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -59.63 -25.55 64.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.316 -0.865 . . . . 0.0 110.199 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.409 ' CG ' ' HG3' ' A' ' 46' ' ' GLU . 30.0 ttmt -76.46 -64.54 1.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.331 -0.856 . . . . 0.0 110.159 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.48 HG11 HD13 ' A' ' 56' ' ' LEU . 59.1 t -49.88 -33.65 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.493 -0.754 . . . . 0.0 110.699 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -42.13 -38.9 1.82 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.631 -0.668 . . . . 0.0 111.728 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -145.26 21.82 1.54 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.998 -1.064 . . . . 0.0 111.183 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.445 ' N ' ' HD2' ' A' ' 47' ' ' PRO . 2.2 tm-20 -79.02 -55.62 0.92 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 120.993 -1.067 . . . . 0.0 110.423 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' A' ' 46' ' ' GLU . 50.3 Cg_endo -75.67 170.05 21.01 Favored 'Trans proline' 0 C--N 1.313 -1.327 0 O-C-N 123.545 1.287 . . . . 0.0 110.553 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.6 m -136.51 -40.07 0.64 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 110.358 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -95.27 -161.76 0.89 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.851 . . . . 0.0 110.311 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -61.11 -16.63 46.26 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 110.64 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -56.7 -19.07 14.72 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.221 -0.924 . . . . 0.0 110.674 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.603 ' HG2' HG21 ' A' ' 22' ' ' THR . 73.0 ttt180 -50.6 -64.95 0.65 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.266 -0.897 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.472 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -61.98 -51.88 66.28 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -44.35 -46.37 9.31 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.483 -0.76 . . . . 0.0 111.091 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.6 tpt -67.01 -28.48 68.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.097 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 30' ' ' ILE . 14.3 tp -81.93 -35.58 28.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.326 -0.859 . . . . 0.0 110.71 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.6 ' HA ' HD12 ' A' ' 60' ' ' ILE . 3.3 mm -60.49 -36.27 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.216 -0.927 . . . . 0.0 110.504 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.1 mttp -70.1 -46.35 65.02 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.276 -0.89 . . . . 0.0 110.675 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.438 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.3 OUTLIER -56.2 -24.92 44.96 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.166 -0.958 . . . . 0.0 110.652 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.6 HD12 ' HA ' ' A' ' 57' ' ' ILE . 95.3 mt -69.71 -57.48 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.229 -0.919 . . . . 0.0 109.68 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.714 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.9 mm? -78.06 -35.52 49.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.563 -0.711 . . . . 0.0 110.854 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.73 -26.27 65.5 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -65.04 0.73 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.289 -0.882 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -160.1 169.12 24.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.253 -0.904 . . . . 0.0 110.268 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -82.92 -26.4 31.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.39 -0.819 . . . . 0.0 110.237 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -63.66 -39.48 94.45 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 110.24 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 12.1 t -60.54 -31.27 70.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.286 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CE2' HG12 ' A' ' 91' ' ' ILE . 1.9 t80 -62.99 -43.03 99.92 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.371 -0.831 . . . . 0.0 109.957 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.46 -37.15 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.0 t -67.47 -35.2 78.72 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.323 -0.861 . . . . 0.0 109.968 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.582 ' CE1' HD11 ' A' ' 75' ' ' LEU . 6.3 t80 -59.26 -29.9 67.89 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.41 -0.806 . . . . 0.0 109.8 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.523 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 37.7 t80 -70.35 -49.84 45.17 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.366 -0.834 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -73.81 -29.36 62.12 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.341 -0.849 . . . . 0.0 110.452 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.31 76.77 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.339 -0.851 . . . . 0.0 110.281 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.637 HD21 ' CG2' ' A' ' 25' ' ' ILE . 21.3 mt -84.15 -36.37 22.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.376 -0.828 . . . . 0.0 110.28 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.523 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 26.6 mt -67.43 -14.83 63.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.404 -0.81 . . . . 0.0 110.54 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -54.35 -24.0 17.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.272 -0.892 . . . . 0.0 110.69 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.64 -75.05 0.61 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.271 -0.893 . . . . 0.0 110.174 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.36 55.17 0.18 Allowed Glycine 0 N--CA 1.492 2.406 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -107.5 16.17 24.09 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -1.059 . . . . 0.0 110.575 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.683 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 26.0 ttmt -47.35 -34.96 7.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.274 -0.891 . . . . 0.0 110.77 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -48.99 36.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.362 -0.836 . . . . 0.0 109.86 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.427 ' O ' HD12 ' A' ' 87' ' ' LEU . 5.6 tt -69.37 -49.89 51.26 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 109.991 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.69 -28.33 69.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.461 -0.774 . . . . 0.0 110.171 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -59.83 -42.29 93.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.835 . . . . 0.0 110.195 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.476 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 48.1 tp -65.39 -30.79 71.64 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.371 -0.831 . . . . 0.0 110.191 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.504 HD22 ' CE2' ' A' ' 71' ' ' PHE . 1.1 mt -81.82 -27.89 33.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.399 -0.813 . . . . 0.0 110.109 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -77.53 -45.97 23.81 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.421 -0.8 . . . . 0.0 110.284 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.17 -19.96 65.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.355 -0.841 . . . . 0.0 110.328 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -81.01 -17.35 72.49 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.568 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 27.8 mt -65.62 -54.67 28.4 Favored Pre-proline 0 N--CA 1.493 1.69 0 O-C-N 121.19 -1.183 . . . . 0.0 110.68 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.568 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 45.2 Cg_endo -71.08 -49.77 0.36 Allowed 'Trans proline' 0 C--N 1.314 -1.258 0 O-C-N 123.331 1.174 . . . . 0.0 110.684 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.9 t -117.5 140.83 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.303 -0.873 . . . . 0.0 110.192 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.432 HG22 ' HB2' ' A' ' 8' ' ' CYS . 58.0 t -119.35 -9.41 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.393 -0.817 . . . . 0.0 110.529 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 28.9 t -61.04 -69.27 0.24 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.218 -0.926 . . . . 0.0 110.263 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.3 m -100.68 -40.76 7.21 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.351 -0.843 . . . . 0.0 110.196 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.195 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.199 0.523 . . . . 0.0 110.253 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -152.8 155.25 36.78 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.39 -0.819 . . . . 0.0 110.236 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.409 ' O ' ' ND2' ' A' ' 7' ' ' ASN . . . -63.8 -24.84 67.92 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.323 -0.861 . . . . 0.0 110.296 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -58.76 -41.88 87.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.305 -0.872 . . . . 0.0 110.265 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.529 ' CB ' HG23 ' A' ' 91' ' ' ILE . . . -60.13 -40.91 91.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.34 -0.85 . . . . 0.0 110.087 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -64.15 -39.51 94.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.381 -0.825 . . . . 0.0 110.013 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.409 ' ND2' ' O ' ' A' ' 3' ' ' ALA . 62.6 m-80 -70.76 -27.55 64.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.405 -0.809 . . . . 0.0 110.032 179.82 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 t -62.08 -59.42 5.1 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.398 -0.814 . . . . 0.0 110.149 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.801 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -52.51 -35.68 53.65 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.311 -0.868 . . . . 0.0 109.987 179.732 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 mt -80.75 -21.52 40.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.36 -0.837 . . . . 0.0 110.53 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -115.45 24.57 11.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.923 . . . . 0.0 110.483 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.422 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 8.2 t-80 -130.95 34.07 4.11 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.303 -0.873 . . . . 0.0 110.12 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.4 ttp-105 -71.27 -25.17 62.34 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.363 -0.836 . . . . 0.0 110.256 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.14 -34.14 69.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.238 -0.914 . . . . 0.0 110.158 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.422 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -77.95 -44.56 26.5 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.431 -0.793 . . . . 0.0 110.038 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.696 HD22 HG12 ' A' ' 57' ' ' ILE . 3.5 tp -65.28 -38.68 91.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.308 -0.87 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.58 -42.99 79.61 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.324 -0.86 . . . . 0.0 110.12 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -81.75 -24.31 36.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.367 -0.833 . . . . 0.0 110.028 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -81.16 -64.86 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.285 -0.884 . . . . 0.0 110.179 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.916 HD13 HG13 ' A' ' 25' ' ' ILE . 19.9 mt -128.59 163.17 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 0.0 110.404 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.56 ' O ' ' C ' ' A' ' 22' ' ' THR . 9.2 mttt -125.48 142.41 51.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.616 -0.677 . . . . 0.0 109.383 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.571 HG23 ' HB2' ' A' ' 53' ' ' ALA . 66.7 p -24.05 98.37 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.549 0.69 . . . . 0.0 111.075 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' TYR . 40.0 m -155.85 -175.81 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.638 . . . . 0.0 110.036 -178.609 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -33.01 -36.47 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.895 -0.503 . . . . 0.0 112.039 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.916 HG13 HD13 ' A' ' 20' ' ' ILE . 42.9 mm -54.61 -65.17 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 120.99 -1.069 . . . . 0.0 110.221 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.496 ' HE1' HG13 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -75.41 -35.85 60.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.349 -0.845 . . . . 0.0 110.436 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.18 -48.96 77.73 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.34 -0.85 . . . . 0.0 110.564 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -55.86 -40.5 73.0 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.224 -0.923 . . . . 0.0 110.509 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -61.36 -50.27 73.57 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.328 -0.858 . . . . 0.0 110.237 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.953 HG23 ' HB2' ' A' ' 35' ' ' LEU . 21.1 mt -58.97 -25.52 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.392 -0.817 . . . . 0.0 110.418 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.3 m -96.89 -14.69 21.63 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.355 -0.841 . . . . 0.0 110.573 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -74.98 -3.0 29.75 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.238 -0.914 . . . . 0.0 110.771 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.15 8.17 7.36 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.66 ' C ' HD22 ' A' ' 35' ' ' LEU . 19.2 m-85 -80.38 -70.36 0.53 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.115 -1.227 . . . . 0.0 110.376 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.953 ' HB2' HG23 ' A' ' 30' ' ' ILE . 3.9 mm? -108.67 164.64 12.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.387 -0.82 . . . . 0.0 110.04 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.4 p -60.83 158.66 12.56 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.324 -0.86 . . . . 0.0 110.146 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -73.91 -28.15 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.364 -0.835 . . . . 0.0 110.136 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -59.96 -30.19 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.197 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.31 -26.85 63.97 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.387 -0.821 . . . . 0.0 110.212 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -68.39 -35.18 77.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.33 -0.856 . . . . 0.0 110.156 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -69.91 -30.63 68.1 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.388 -0.82 . . . . 0.0 110.075 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -66.62 -63.5 1.06 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 110.131 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.402 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 65.0 t -47.14 -33.56 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.45 -0.781 . . . . 0.0 110.644 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -46.55 -47.55 19.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.54 -0.725 . . . . 0.0 111.369 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -145.07 13.98 1.47 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.064 -1.022 . . . . 0.0 111.309 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.64 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 15.6 tp10 -80.59 -47.64 1.23 Allowed Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.043 -1.036 . . . . 0.0 110.974 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.64 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.7 Cg_endo -76.45 169.95 20.9 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.128 1.067 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.1 m -141.13 -46.8 0.39 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.372 -0.83 . . . . 0.0 110.169 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.76 -160.2 0.47 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.288 -0.882 . . . . 0.0 110.175 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -7.55 50.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.26 -0.9 . . . . 0.0 110.453 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -61.39 -17.12 52.59 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.157 -0.964 . . . . 0.0 110.447 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.472 ' HG2' HG21 ' A' ' 22' ' ' THR . 74.5 ttt180 -50.22 -59.61 3.78 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.244 -0.91 . . . . 0.0 110.387 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.651 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -66.08 -48.06 72.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.347 -0.846 . . . . 0.0 110.001 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -49.25 -34.07 14.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.421 -0.799 . . . . 0.0 110.487 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.9 ttt -79.55 -25.14 41.73 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.429 -0.794 . . . . 0.0 109.974 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.831 HD11 ' CD1' ' A' ' 30' ' ' ILE . 14.0 tp -79.16 -49.18 12.98 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.336 -0.853 . . . . 0.0 110.105 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.696 HG12 HD22 ' A' ' 16' ' ' LEU . 2.5 mp -56.8 -30.9 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.318 -0.864 . . . . 0.0 109.997 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -75.15 -43.36 52.89 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.345 -0.847 . . . . 0.0 110.191 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 17.3 mmt -58.46 -30.96 67.35 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.419 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.621 HD12 ' HA ' ' A' ' 57' ' ' ILE . 81.7 mt -68.18 -58.0 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.02 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.422 HD21 ' HG ' ' A' ' 9' ' ' LEU . 1.5 mm? -68.66 -40.34 80.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.375 -0.828 . . . . 0.0 110.502 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -55.58 -24.97 35.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.309 -0.869 . . . . 0.0 110.572 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -63.95 0.96 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.277 -0.89 . . . . 0.0 110.263 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -160.07 167.97 26.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.295 -0.878 . . . . 0.0 110.272 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -76.61 -36.46 57.46 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.17 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.37 -28.49 69.27 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.332 -0.855 . . . . 0.0 110.124 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.427 ' HG ' ' HE2' ' A' ' 34' ' ' PHE . 2.1 t -59.82 -48.58 81.11 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.38 -0.825 . . . . 0.0 110.139 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.801 ' CE1' HD23 ' A' ' 9' ' ' LEU . 4.0 t80 -57.71 -32.35 67.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.414 -0.804 . . . . 0.0 110.179 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.57 -44.09 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.333 -0.855 . . . . 0.0 109.939 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.4 t -65.51 -32.66 74.39 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.388 -0.82 . . . . 0.0 110.002 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.464 ' CE1' HD13 ' A' ' 87' ' ' LEU . 2.6 t80 -55.66 -41.54 73.79 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.339 -0.851 . . . . 0.0 109.857 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.74 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 38.4 t80 -62.71 -43.28 99.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.31 -0.869 . . . . 0.0 110.112 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -70.49 -24.83 62.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 110.404 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.88 -52.33 37.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.26 -0.9 . . . . 0.0 110.326 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.1 mt -62.72 -38.54 90.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.345 -0.847 . . . . 0.0 110.264 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.74 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 34.1 mt -66.91 -15.17 63.49 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.398 -0.814 . . . . 0.0 110.457 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.25 -22.93 66.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.25 -0.906 . . . . 0.0 110.478 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.69 -75.17 0.64 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.205 -0.935 . . . . 0.0 110.374 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.53 36.9 0.11 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.762 ' CE2' HD11 ' A' ' 20' ' ' ILE . 28.5 m-85 -92.9 16.38 12.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.493 -1.004 . . . . 0.0 110.441 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 21.8 tttp -42.4 -30.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.413 -0.804 . . . . 0.0 111.034 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -78.83 -48.86 13.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.314 -0.866 . . . . 0.0 109.913 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.656 ' C ' HD13 ' A' ' 83' ' ' LEU . 2.7 tm? -72.71 -48.59 37.54 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.013 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.52 -34.71 72.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.387 -0.82 . . . . 0.0 110.139 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.632 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.3 -36.1 77.12 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.358 -0.839 . . . . 0.0 110.082 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 39.3 tp -61.88 -40.32 95.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.302 -0.874 . . . . 0.0 110.327 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.464 HD13 ' CE1' ' A' ' 71' ' ' PHE . 1.1 mt -74.95 -30.04 61.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.359 -0.838 . . . . 0.0 110.276 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.457 ' HA ' HD12 ' A' ' 91' ' ' ILE . 5.6 t60 -84.97 -27.03 26.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.472 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.75 -23.19 42.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.318 -0.864 . . . . 0.0 110.31 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -80.41 -24.96 58.02 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.569 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.5 mt -59.63 -56.08 39.4 Favored Pre-proline 0 N--CA 1.493 1.685 0 O-C-N 121.189 -1.183 . . . . 0.0 110.45 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.569 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo -70.82 -81.37 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.307 0 O-C-N 123.274 1.144 . . . . 0.0 110.705 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.483 HG12 ' N ' ' A' ' 94' ' ' VAL . 67.5 t -70.92 166.67 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.181 -0.949 . . . . 0.0 110.08 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.483 ' N ' HG12 ' A' ' 93' ' ' VAL . 59.0 t -99.64 -56.52 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.359 -0.838 . . . . 0.0 110.134 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 9.9 t -124.67 -69.66 0.79 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.29 -0.881 . . . . 0.0 110.304 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.98 -53.89 1.05 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.318 -0.864 . . . . 0.0 110.302 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.0 p . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.19 -179.95 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 ttm . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.23 0.538 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -68.25 161.76 26.52 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.413 -0.805 . . . . 0.0 110.102 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.86 -24.98 58.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.401 -0.812 . . . . 0.0 110.414 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 ttmm -59.99 -34.98 74.05 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.349 -0.844 . . . . 0.0 110.552 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.43 82.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.234 -0.916 . . . . 0.0 110.139 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.449 ' O ' HD12 ' A' ' 10' ' ' LEU . 56.0 ttp180 -64.77 -31.75 73.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.333 -0.854 . . . . 0.0 109.997 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -74.88 -27.65 60.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.427 -0.796 . . . . 0.0 109.818 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 t -62.01 -50.65 71.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.431 -0.793 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.674 ' O ' HD13 ' A' ' 9' ' ' LEU . 2.1 tm? -59.38 -38.48 80.62 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.35 -0.844 . . . . 0.0 109.871 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 6' ' ' ARG . 12.0 mt -72.5 -30.69 64.73 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.334 -0.854 . . . . 0.0 110.147 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -81.97 -4.66 57.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.348 -0.845 . . . . 0.0 110.639 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.662 ' ND1' ' HB3' ' A' ' 15' ' ' ALA . 0.8 OUTLIER -96.38 34.01 1.69 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.233 -0.917 . . . . 0.0 110.25 179.919 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -75.8 -41.57 52.43 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.846 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.28 -35.67 27.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.208 -0.933 . . . . 0.0 110.953 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.662 ' HB3' ' ND1' ' A' ' 12' ' ' HIS . . . -75.13 -25.85 58.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.077 -1.015 . . . . 0.0 110.267 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.576 HD11 ' CE ' ' A' ' 26' ' ' MET . 7.1 tt -85.28 -29.28 24.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.87 . . . . 0.0 109.831 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.69 -38.19 86.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 ttmt -84.34 -31.54 24.74 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 110.345 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -84.46 -65.54 1.0 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.312 -0.867 . . . . 0.0 110.364 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.534 HD12 HG13 ' A' ' 25' ' ' ILE . 15.2 mm -108.99 109.56 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.388 -0.82 . . . . 0.0 110.224 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.559 ' O ' ' C ' ' A' ' 22' ' ' THR . 34.3 mtpt -100.56 141.4 33.47 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.509 -0.744 . . . . 0.0 109.438 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.689 HG22 HD22 ' A' ' 56' ' ' LEU . 73.2 p -25.02 97.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.302 0 CA-C-O 121.49 0.662 . . . . 0.0 111.122 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 7.8 t -160.34 -176.25 5.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.473 -0.767 . . . . 0.0 110.285 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.444 ' CD1' ' HB2' ' A' ' 28' ' ' HIS . 9.2 t80 -33.28 -39.25 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.859 -0.526 . . . . 0.0 111.866 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.534 HG13 HD12 ' A' ' 20' ' ' ILE . 46.2 mm -57.74 -64.1 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.044 -1.035 . . . . 0.0 110.029 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.748 ' HB3' HD21 ' A' ' 56' ' ' LEU . 7.5 mmt -75.23 -34.36 61.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.323 -0.861 . . . . 0.0 110.198 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -59.38 4.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.456 -0.777 . . . . 0.0 110.402 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . 11.4 t-80 -54.52 -24.92 22.75 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.329 -0.857 . . . . 0.0 110.474 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.41 ' O ' ' CD2' ' A' ' 34' ' ' PHE . 33.8 mtt -72.41 -38.58 68.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -0.909 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.732 HD11 HD11 ' A' ' 56' ' ' LEU . 82.5 mt -61.39 -50.18 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.248 -0.908 . . . . 0.0 110.049 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.8 m -74.76 -15.57 60.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 110.455 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.45 -25.49 50.84 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.276 -0.89 . . . . 0.0 110.431 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 139.45 -13.72 3.22 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.484 ' CB ' HD12 ' A' ' 35' ' ' LEU . 17.4 m-30 -58.56 -61.83 2.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.14 -1.212 . . . . 0.0 110.44 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.708 HD22 ' OE1' ' A' ' 39' ' ' GLU . 3.9 mp -125.46 165.19 18.89 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.264 -0.897 . . . . 0.0 110.423 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 p -57.23 173.53 0.24 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.446 -0.784 . . . . 0.0 110.397 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.544 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.3 mp -85.35 -21.44 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.424 -0.797 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.9 m -57.91 -27.21 63.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.279 -0.888 . . . . 0.0 110.315 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.708 ' OE1' HD22 ' A' ' 35' ' ' LEU . 38.3 tt0 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.391 -0.818 . . . . 0.0 110.149 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -62.12 -32.26 72.81 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.361 -0.837 . . . . 0.0 110.114 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.84 -32.13 69.06 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.391 -0.818 . . . . 0.0 110.167 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -75.58 -54.94 6.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.06 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.6 t -53.36 -33.85 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.379 -0.826 . . . . 0.0 110.47 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -46.7 -36.57 7.29 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.378 -0.826 . . . . 0.0 110.878 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -144.17 20.8 1.75 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.282 -0.886 . . . . 0.0 110.543 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.7 tt0 -81.91 -57.02 0.53 Allowed Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 0.0 110.741 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 46.7 Cg_endo -72.49 170.09 20.19 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 O-C-N 123.307 1.162 . . . . 0.0 110.631 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 27.0 m -140.79 -43.03 0.39 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.436 -0.79 . . . . 0.0 110.1 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -98.33 -154.35 0.46 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.443 -0.786 . . . . 0.0 110.055 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -66.61 -12.55 58.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.281 -0.887 . . . . 0.0 110.609 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -57.47 -19.29 23.27 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.246 -0.909 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.612 ' HG2' HG21 ' A' ' 22' ' ' THR . 2.1 ttt85 -51.62 -36.41 45.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.275 -0.89 . . . . 0.0 110.715 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.423 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -85.98 -18.0 33.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 110.528 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -83.34 -34.49 25.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.179 -0.95 . . . . 0.0 110.287 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' MET . . . . . 0.473 ' HG2' ' HE1' ' A' ' 59' ' ' MET . 0.7 OUTLIER -77.52 -47.78 18.69 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.342 -0.849 . . . . 0.0 110.427 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.748 HD21 ' HB3' ' A' ' 26' ' ' MET . 17.7 tp -55.76 -40.76 73.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.355 -0.84 . . . . 0.0 110.548 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.655 ' HA ' HD12 ' A' ' 60' ' ' ILE . 0.9 OUTLIER -67.88 -26.4 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.337 -0.852 . . . . 0.0 109.957 179.885 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.3 mtmm -70.9 -48.76 51.92 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.233 -0.917 . . . . 0.0 109.924 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' MET . . . . . 0.473 ' HE1' ' HG2' ' A' ' 55' ' ' MET . 0.0 OUTLIER -52.77 -30.52 33.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.295 -0.878 . . . . 0.0 110.447 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.655 HD12 ' HA ' ' A' ' 57' ' ' ILE . 85.1 mt -63.88 -53.01 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.329 -0.857 . . . . 0.0 109.873 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.516 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.7 mm? -82.17 -27.31 32.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.458 -0.776 . . . . 0.0 110.699 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -60.74 -29.59 69.48 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.385 -0.822 . . . . 0.0 110.529 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -76.01 -65.07 0.96 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.24 -0.913 . . . . 0.0 110.389 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.28 169.99 22.05 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 0.0 110.218 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -80.58 -21.68 41.44 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.37 -0.831 . . . . 0.0 110.312 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -61.06 -39.37 89.59 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.18 -0.95 . . . . 0.0 110.232 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.4 t -60.11 -28.41 67.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.333 -0.854 . . . . 0.0 110.139 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.585 ' HE1' HD23 ' A' ' 9' ' ' LEU . 16.2 t80 -70.4 -35.83 73.7 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 109.954 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.59 -41.68 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.118 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.3 t -63.73 -36.84 85.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.299 -0.876 . . . . 0.0 110.182 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.574 ' CE1' HD22 ' A' ' 87' ' ' LEU . 5.9 t80 -57.05 -38.3 73.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.398 -0.814 . . . . 0.0 110.175 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.677 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 35.2 t80 -64.23 -43.33 95.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 110.372 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -76.84 -25.4 53.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.366 -0.834 . . . . 0.0 110.477 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.19 -35.84 80.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.284 -0.885 . . . . 0.0 110.45 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.536 HD11 ' CE2' ' A' ' 71' ' ' PHE . 11.6 mt -80.22 -40.98 26.02 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.607 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 39.2 mt -66.58 -14.97 63.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.712 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -63.71 -22.78 67.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.244 -0.91 . . . . 0.0 110.547 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -109.91 -75.27 0.63 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.207 -0.933 . . . . 0.0 110.459 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.04 37.0 0.1 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -94.45 16.47 15.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.506 -0.996 . . . . 0.0 110.588 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 38.5 ttpt -41.49 -32.39 0.33 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.483 -0.761 . . . . 0.0 110.929 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -67.35 -47.42 70.49 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.344 -0.848 . . . . 0.0 109.63 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.537 HD13 ' O ' ' A' ' 83' ' ' LEU . 1.1 tm? -69.94 -51.42 32.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.47 -0.769 . . . . 0.0 109.829 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.677 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.26 -30.04 69.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.44 -0.787 . . . . 0.0 110.202 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.604 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -58.83 -41.35 86.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.32 -0.863 . . . . 0.0 110.124 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.356 -0.84 . . . . 0.0 110.173 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.574 HD22 ' CE1' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -70.34 -34.48 72.7 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.318 -0.864 . . . . 0.0 110.214 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.455 ' HA ' HD12 ' A' ' 91' ' ' ILE . 13.9 t-80 -77.87 -16.63 58.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.348 -0.845 . . . . 0.0 110.493 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.15 -14.97 45.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.293 -0.879 . . . . 0.0 110.545 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -109.58 -22.82 6.53 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.568 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 19.3 mt -59.93 -57.39 27.12 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.198 -1.177 . . . . 0.0 110.437 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.568 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.2 Cg_endo -70.83 -85.0 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.322 0 O-C-N 123.267 1.14 . . . . 0.0 110.564 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.47 HG12 ' N ' ' A' ' 94' ' ' VAL . 62.6 t -140.06 167.3 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.104 -0.998 . . . . 0.0 109.96 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.47 ' N ' HG12 ' A' ' 93' ' ' VAL . 62.1 t -116.19 -25.9 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.287 -0.883 . . . . 0.0 110.354 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.8 t -81.44 -71.61 0.47 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.332 -0.855 . . . . 0.0 110.266 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 74.3 p -60.51 -38.73 85.29 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.328 -0.857 . . . . 0.0 110.282 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 43.5 t . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.182 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtm . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.184 0.516 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 0.457 ' OD2' ' HB3' ' A' ' 5' ' ' ALA . 36.8 p-10 -104.23 104.77 14.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.309 -0.869 . . . . 0.0 110.398 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.94 -37.65 61.94 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.348 -0.845 . . . . 0.0 110.271 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -58.16 -41.02 82.92 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.381 -0.824 . . . . 0.0 110.301 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.457 ' HB3' ' OD2' ' A' ' 2' ' ' ASP . . . -68.0 -41.18 82.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.335 -0.853 . . . . 0.0 110.091 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -66.82 -32.87 74.43 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.365 -0.834 . . . . 0.0 110.07 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -75.23 -27.78 59.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.344 -0.848 . . . . 0.0 110.283 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.3 t -60.68 -58.35 8.84 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.261 -0.899 . . . . 0.0 110.111 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.757 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -57.58 -34.71 69.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.379 -0.826 . . . . 0.0 110.046 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.1 mt -81.27 -21.2 39.56 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.343 -0.848 . . . . 0.0 110.471 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -116.66 53.67 0.88 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.306 -0.871 . . . . 0.0 110.427 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.491 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 4.5 t-160 -159.78 42.37 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.333 -0.854 . . . . 0.0 109.772 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.533 ' CD ' ' HB2' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -75.15 -33.78 61.55 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.474 -0.766 . . . . 0.0 110.565 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -58.99 -35.49 73.31 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.217 -0.927 . . . . 0.0 110.23 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.491 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -85.43 -34.98 21.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.433 -0.792 . . . . 0.0 110.141 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.631 ' C ' HD13 ' A' ' 16' ' ' LEU . 3.0 tm? -64.1 -46.41 84.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.387 -0.821 . . . . 0.0 109.871 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -61.65 -43.52 98.7 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.492 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -66.11 -42.29 89.41 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.362 -0.836 . . . . 0.0 110.524 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.569 ' CG ' HD23 ' A' ' 83' ' ' LEU . 19.9 m-20 -80.28 -64.87 1.09 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.398 -0.814 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.774 HD12 HG13 ' A' ' 25' ' ' ILE . 24.9 mm -102.79 166.26 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.313 -0.867 . . . . 0.0 110.203 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.536 ' O ' ' C ' ' A' ' 22' ' ' THR . 38.9 mtmt -153.64 141.14 19.8 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.46 -0.775 . . . . 0.0 109.531 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.571 HG21 ' HG2' ' A' ' 52' ' ' ARG . 70.7 p -25.85 94.65 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 121.455 0.645 . . . . 0.0 111.175 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 21' ' ' LYS . 26.5 m -165.23 -175.85 3.82 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.632 -0.667 . . . . 0.0 109.923 -178.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.44 ' C ' ' O ' ' A' ' 23' ' ' SER . 7.9 t80 -33.66 -34.72 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.883 -0.511 . . . . 0.0 111.841 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.774 HG13 HD12 ' A' ' 20' ' ' ILE . 44.2 mm -53.49 -65.46 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.063 -1.023 . . . . 0.0 110.027 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.63 ' HE1' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -75.78 -37.9 58.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.23 -0.918 . . . . 0.0 110.216 179.55 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -57.65 -50.37 73.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.7 -33.17 69.88 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.247 -0.908 . . . . 0.0 110.075 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.0 mtt -68.41 -58.08 4.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.512 -0.742 . . . . 0.0 110.008 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.75 HG23 ' HB2' ' A' ' 35' ' ' LEU . 8.3 mt -56.47 -27.33 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.392 -0.817 . . . . 0.0 110.07 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 33.5 m -88.67 -22.62 23.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.344 -0.847 . . . . 0.0 110.261 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -59.76 -26.82 66.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.328 -0.858 . . . . 0.0 110.33 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.64 -15.2 2.91 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.546 ' CB ' HD12 ' A' ' 35' ' ' LEU . 25.0 m-85 -57.82 -47.67 81.95 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -1.175 . . . . 0.0 110.35 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.75 ' HB2' HG23 ' A' ' 30' ' ' ILE . 4.7 mp -132.07 165.13 24.7 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.347 -0.845 . . . . 0.0 110.387 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -70.43 171.85 9.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.39 -0.819 . . . . 0.0 110.265 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 49.4 mm -84.96 -18.77 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.824 . . . . 0.0 110.35 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.0 m -55.79 -26.25 45.21 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.24 -0.912 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.423 ' O ' HG23 ' A' ' 43' ' ' VAL . 26.9 tt0 -73.64 -28.03 61.57 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -71.56 -41.69 68.75 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.363 -0.835 . . . . 0.0 110.246 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -64.15 -27.69 69.25 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.32 -0.862 . . . . 0.0 110.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -80.19 -60.98 2.12 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.173 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 39' ' ' GLU . 65.3 t -48.41 -33.85 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.442 -0.787 . . . . 0.0 110.668 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -46.62 -42.72 16.61 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.464 -0.772 . . . . 0.0 111.173 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -145.22 17.25 1.54 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.114 -0.991 . . . . 0.0 110.974 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.63 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.1 OUTLIER -79.55 -47.66 1.5 Allowed Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.048 -1.033 . . . . 0.0 110.721 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -77.13 170.08 20.31 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.262 1.138 . . . . 0.0 110.334 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.8 m -129.25 -41.46 1.4 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.386 -0.821 . . . . 0.0 110.355 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -98.41 -159.61 0.75 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.355 -0.84 . . . . 0.0 110.363 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -65.74 -12.13 51.35 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.369 -0.832 . . . . 0.0 110.715 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -55.63 -20.03 12.43 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.152 -0.967 . . . . 0.0 110.678 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.571 ' HG2' HG21 ' A' ' 22' ' ' THR . 24.3 ttp180 -49.65 -37.43 28.28 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.177 -0.952 . . . . 0.0 110.592 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.771 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -79.1 -53.04 7.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.367 -0.833 . . . . 0.0 110.113 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.533 ' HB2' ' CD ' ' A' ' 13' ' ' ARG . . . -50.45 -26.47 5.12 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.44 -0.788 . . . . 0.0 110.619 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.8 tpt -82.99 -28.04 29.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.318 -0.864 . . . . 0.0 110.241 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.447 HD11 HD13 ' A' ' 30' ' ' ILE . 14.0 tp -84.89 -50.85 7.17 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.771 HD12 ' O ' ' A' ' 53' ' ' ALA . 2.7 mp -58.93 -36.66 62.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.328 -0.858 . . . . 0.0 110.072 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -66.56 -37.53 85.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.323 -0.861 . . . . 0.0 109.929 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.7 mmt -61.27 -27.79 68.71 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.413 -0.804 . . . . 0.0 110.14 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.689 HD12 ' HA ' ' A' ' 57' ' ' ILE . 87.0 mt -66.72 -53.62 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.354 -0.841 . . . . 0.0 109.889 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.423 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -77.47 -34.06 54.45 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.51 -0.744 . . . . 0.0 110.535 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -25.08 67.5 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.279 -0.888 . . . . 0.0 110.339 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -77.35 -64.51 1.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 110.355 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -153.6 166.49 32.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.388 -0.82 . . . . 0.0 110.371 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -85.21 -25.33 27.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.8 . . . . 0.0 110.246 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.48 -35.25 71.9 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.338 -0.851 . . . . 0.0 110.382 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.8 t -64.45 -34.07 77.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.354 -0.841 . . . . 0.0 110.127 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.609 ' HE1' HD23 ' A' ' 9' ' ' LEU . 18.5 t80 -60.58 -44.89 95.71 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.4 -0.812 . . . . 0.0 110.023 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.15 -34.29 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.804 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.8 t -73.58 -29.43 62.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.41 -0.806 . . . . 0.0 109.978 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.612 ' CE2' HD11 ' A' ' 75' ' ' LEU . 10.4 t80 -57.47 -44.54 84.93 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.499 -0.751 . . . . 0.0 109.771 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.583 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 46.3 t80 -61.05 -45.79 93.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.459 -0.776 . . . . 0.0 110.072 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -76.42 -23.58 53.99 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.351 -0.843 . . . . 0.0 110.577 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.89 -32.01 70.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.612 HD11 ' CE2' ' A' ' 71' ' ' PHE . 3.9 mt -84.9 -39.23 18.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.204 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.583 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 23.0 mt -67.2 -14.73 63.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.408 -0.808 . . . . 0.0 110.524 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 -56.78 -24.75 52.65 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.0 110.643 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -116.78 -75.08 0.58 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.167 -0.958 . . . . 0.0 110.394 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.37 67.35 0.14 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -125.08 16.37 8.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.406 -1.056 . . . . 0.0 110.509 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ttmt -44.34 -30.93 0.91 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.473 -0.767 . . . . 0.0 110.96 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.61 -49.12 67.34 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.355 -0.841 . . . . 0.0 109.791 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.659 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.1 tm? -78.84 -40.49 32.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.427 -0.795 . . . . 0.0 109.798 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.438 ' HB3' HD21 ' A' ' 76' ' ' LEU . . . -60.37 -45.91 91.83 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.1 -29.21 70.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.334 -0.854 . . . . 0.0 110.07 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 86' ' ' LEU . 23.2 tp -59.99 -50.19 74.72 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.446 -0.783 . . . . 0.0 110.212 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 mp -77.4 -25.3 50.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.258 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.472 ' HA ' HD12 ' A' ' 91' ' ' ILE . 2.0 t60 -68.74 -41.11 79.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.303 -0.873 . . . . 0.0 110.359 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.62 -22.19 64.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.259 -0.901 . . . . 0.0 110.543 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -84.9 -19.71 59.03 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.566 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.8 mt -60.67 -53.91 59.83 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.171 -1.193 . . . . 0.0 110.576 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.566 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.4 Cg_endo -71.26 -88.66 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 123.271 1.143 . . . . 0.0 110.547 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.598 HG12 ' H ' ' A' ' 95' ' ' SER . 48.5 t -145.84 147.75 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.169 -0.957 . . . . 0.0 109.92 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 63.1 t -78.29 -26.37 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.412 -0.805 . . . . 0.0 110.292 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.598 ' H ' HG12 ' A' ' 93' ' ' VAL . 6.1 t -98.62 -15.99 19.25 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.897 . . . . 0.0 110.715 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.54 5.08 20.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.146 -0.972 . . . . 0.0 110.81 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.069 -1.019 . . . . 0.0 110.164 179.997 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.209 0.528 . . . . 0.0 110.241 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -133.9 107.61 7.94 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.391 -0.818 . . . . 0.0 110.118 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.21 -24.95 57.83 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.317 -0.864 . . . . 0.0 110.458 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -55.08 -34.64 63.78 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.283 -0.886 . . . . 0.0 110.379 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.56 -39.04 92.38 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -63.8 -30.24 71.36 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.388 -0.82 . . . . 0.0 109.851 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -72.82 -37.14 67.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.493 -0.754 . . . . 0.0 109.959 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.8 t -63.27 -50.18 71.15 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.374 -0.829 . . . . 0.0 110.156 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.759 ' O ' HD13 ' A' ' 9' ' ' LEU . 1.5 tm? -60.18 -36.58 77.92 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.277 -0.889 . . . . 0.0 109.913 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.9 mt -68.23 -31.04 70.25 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.85 . . . . 0.0 109.961 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -97.07 22.9 7.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.403 -0.81 . . . . 0.0 110.16 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.457 ' ND1' ' HB3' ' A' ' 15' ' ' ALA . 45.9 t-80 -107.97 23.25 14.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.898 . . . . 0.0 110.331 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.584 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 49.1 ttp180 -67.94 -47.5 68.53 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.232 -0.917 . . . . 0.0 110.003 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.71 -35.38 77.88 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.362 -0.836 . . . . 0.0 110.111 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.457 ' HB3' ' ND1' ' A' ' 12' ' ' HIS . . . -78.81 -43.87 24.37 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.399 -0.813 . . . . 0.0 110.074 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.898 HD21 ' CE ' ' A' ' 26' ' ' MET . 2.3 tm? -59.09 -50.36 74.36 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.296 -0.878 . . . . 0.0 109.692 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.91 -54.07 51.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.335 -0.853 . . . . 0.0 110.225 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -61.84 -27.55 68.86 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.29 -0.881 . . . . 0.0 110.167 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.697 ' HB3' HD11 ' A' ' 83' ' ' LEU . 63.6 m-20 -85.1 -65.19 1.04 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.41 -0.806 . . . . 0.0 110.317 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.905 HD13 HG13 ' A' ' 25' ' ' ILE . 22.1 mt -134.38 147.12 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.307 -0.87 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.58 ' O ' ' C ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -106.44 141.98 36.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.562 -0.711 . . . . 0.0 109.298 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.58 ' C ' ' O ' ' A' ' 21' ' ' LYS . 81.8 p -24.17 98.49 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.493 0.663 . . . . 0.0 110.891 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 24' ' ' TYR . 3.3 m -152.22 -175.68 5.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.69 -0.631 . . . . 0.0 110.183 -178.51 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.425 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -32.91 -37.43 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.896 -0.503 . . . . 0.0 112.064 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.905 HG13 HD13 ' A' ' 20' ' ' ILE . 44.3 mm -52.45 -65.25 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.901 -1.125 . . . . 0.0 110.169 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.898 ' CE ' HD21 ' A' ' 16' ' ' LEU . 2.1 mpt? -75.16 -50.49 16.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.891 . . . . 0.0 110.392 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -47.44 -51.53 19.86 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.526 -0.734 . . . . 0.0 111.228 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -55.26 -40.09 70.56 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.193 -0.942 . . . . 0.0 110.181 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.419 ' HE1' ' HB2' ' A' ' 71' ' ' PHE . 42.9 mtp -68.11 -32.52 72.87 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.398 -0.814 . . . . 0.0 110.433 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.492 HG23 ' HB2' ' A' ' 35' ' ' LEU . 39.7 mm -61.94 -65.43 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.34 -0.85 . . . . 0.0 110.405 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.2 m -59.94 -19.27 51.0 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.426 -0.796 . . . . 0.0 110.691 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -22.37 32.29 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.18 -0.95 . . . . 0.0 110.407 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.86 -14.53 3.35 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.722 ' C ' HD22 ' A' ' 35' ' ' LEU . 15.0 m-30 -60.91 -67.76 0.37 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.177 -1.19 . . . . 0.0 110.441 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.722 HD22 ' C ' ' A' ' 34' ' ' PHE . 3.8 mm? -113.25 150.05 32.94 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 110.251 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.8 p -62.58 175.18 0.83 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.393 -0.817 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.561 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.7 mp -77.68 -15.64 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.426 -0.797 . . . . 0.0 110.497 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.3 m -61.77 -31.25 71.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.236 -0.915 . . . . 0.0 110.415 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -70.92 -31.05 67.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.329 -0.857 . . . . 0.0 110.274 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -75.16 -27.67 59.81 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.34 -0.85 . . . . 0.0 110.433 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.76 -35.53 77.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.183 -0.948 . . . . 0.0 110.362 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -77.7 -59.75 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.228 -0.92 . . . . 0.0 110.265 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 78.8 t -47.42 -33.44 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.406 -0.809 . . . . 0.0 110.593 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -46.67 -53.17 12.22 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.588 -0.695 . . . . 0.0 111.505 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.82 4.75 2.57 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.05 -1.031 . . . . 0.0 111.645 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.578 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.9 tp10 -75.2 -47.49 4.49 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 120.917 -1.115 . . . . 0.0 110.884 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.0 Cg_endo -74.84 169.99 21.36 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.189 1.099 . . . . 0.0 110.455 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -152.65 -50.37 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.376 -0.827 . . . . 0.0 110.103 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.05 -160.71 0.3 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.379 -0.826 . . . . 0.0 110.076 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -66.76 -13.82 61.87 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.417 -0.802 . . . . 0.0 110.501 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -62.76 -16.29 57.18 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.494 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -51.82 -60.66 2.91 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.249 -0.907 . . . . 0.0 110.518 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.437 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -72.7 -48.37 39.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.324 -0.86 . . . . 0.0 110.299 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.584 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -46.76 -35.53 6.27 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.434 -0.791 . . . . 0.0 110.781 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -82.05 -25.02 34.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.364 -0.835 . . . . 0.0 109.932 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.412 HD23 HG22 ' A' ' 22' ' ' THR . 32.3 tp -80.17 -39.4 29.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 0.0 110.23 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.544 ' HA ' HD12 ' A' ' 60' ' ' ILE . 32.7 mm -63.37 -38.74 82.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 109.933 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.74 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 109.74 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.7 mmt -59.43 -27.81 66.38 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.404 -0.81 . . . . 0.0 110.012 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.544 HD12 ' HA ' ' A' ' 57' ' ' ILE . 91.5 mt -66.99 -49.81 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.515 -0.741 . . . . 0.0 109.959 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.415 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.5 mm? -80.69 -29.21 36.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.475 -0.766 . . . . 0.0 110.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -61.28 -28.92 69.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.317 -0.864 . . . . 0.0 110.451 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -65.27 0.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.386 -0.821 . . . . 0.0 110.249 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -160.24 170.1 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.397 -0.815 . . . . 0.0 110.187 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -81.31 -28.87 34.41 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.382 -0.824 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -61.69 -36.85 82.08 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.351 -0.843 . . . . 0.0 110.251 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 t -59.8 -37.46 79.18 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.658 ' CE1' HD23 ' A' ' 9' ' ' LEU . 11.6 t80 -60.31 -36.29 77.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.328 -0.857 . . . . 0.0 109.862 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.7 t -65.23 -35.58 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.42 -0.8 . . . . 0.0 109.856 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.1 t -69.58 -37.11 76.83 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.401 -0.812 . . . . 0.0 110.046 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.789 ' CE1' HD11 ' A' ' 75' ' ' LEU . 21.5 t80 -52.41 -39.67 61.21 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.429 -0.795 . . . . 0.0 109.918 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.751 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 47.2 t80 -62.46 -51.95 65.48 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.996 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -72.68 -20.6 61.21 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.324 -0.86 . . . . 0.0 110.562 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.78 -41.28 83.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.26 -0.9 . . . . 0.0 110.368 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.789 HD11 ' CE1' ' A' ' 71' ' ' PHE . 2.1 mt -80.03 -35.72 36.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.326 -0.858 . . . . 0.0 110.196 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.542 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 32.2 mt -65.0 -15.55 62.42 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.391 -0.818 . . . . 0.0 110.389 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -58.19 -21.36 47.2 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.203 -0.935 . . . . 0.0 110.467 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -116.96 -75.05 0.58 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.337 -0.852 . . . . 0.0 110.288 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.59 67.74 0.12 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 0.443 ' CZ ' HD11 ' A' ' 20' ' ' ILE . 12.3 m-85 -125.14 16.39 8.44 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.409 -1.053 . . . . 0.0 110.565 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.633 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 67.3 tttt -45.0 -37.55 4.12 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.319 -0.863 . . . . 0.0 110.814 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.64 -44.54 77.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.279 -0.888 . . . . 0.0 109.734 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.697 HD11 ' HB3' ' A' ' 19' ' ' ASP . 4.2 tt -70.24 -53.88 15.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.454 -0.779 . . . . 0.0 109.796 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.751 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.75 -26.58 67.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.431 -0.793 . . . . 0.0 110.322 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.633 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.36 -43.93 96.06 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.346 -0.846 . . . . 0.0 110.154 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.708 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.54 -43.13 99.42 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.363 -0.835 . . . . 0.0 109.852 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.472 HD12 ' O ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -73.33 -34.16 65.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.401 -0.812 . . . . 0.0 110.296 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.59 ' HA ' HD12 ' A' ' 91' ' ' ILE . 54.3 t-80 -70.01 -48.1 59.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.415 -0.803 . . . . 0.0 110.168 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.62 -18.93 61.48 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.361 -0.837 . . . . 0.0 110.405 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.45 -21.81 53.02 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.613 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 57.3 mt -59.26 -52.55 73.66 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.223 -1.163 . . . . 0.0 110.594 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.613 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.9 Cg_endo -72.12 -81.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.293 0 O-C-N 123.328 1.173 . . . . 0.0 110.755 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.411 HG23 ' C ' ' A' ' 92' ' ' PRO . 59.4 t -146.06 141.82 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.066 -1.021 . . . . 0.0 110.13 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 62.3 t -94.28 -25.23 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.347 -0.845 . . . . 0.0 110.163 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.8 t -58.81 -25.71 63.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.303 -0.873 . . . . 0.0 110.387 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.61 5.07 15.31 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.305 -0.872 . . . . 0.0 110.633 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.236 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.189 0.519 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -138.53 149.84 45.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.311 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.5 -24.6 56.88 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.381 -0.824 . . . . 0.0 110.325 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.5 ttmt -51.08 -39.15 55.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.348 -0.845 . . . . 0.0 110.784 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -64.12 -41.23 97.32 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.242 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -67.39 -30.63 70.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.313 -0.867 . . . . 0.0 110.052 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -72.07 -27.43 62.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.375 -0.828 . . . . 0.0 110.062 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -63.21 -56.5 16.15 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.426 -0.796 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.749 ' O ' HD13 ' A' ' 9' ' ' LEU . 1.1 tm? -62.06 -34.8 76.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.414 -0.804 . . . . 0.0 109.777 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.5 mt -65.79 -33.67 76.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.34 -0.85 . . . . 0.0 110.014 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -94.04 18.9 9.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.333 -0.854 . . . . 0.0 110.267 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -103.45 26.24 8.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.924 . . . . 0.0 110.055 179.909 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.531 ' CD ' ' HB1' ' A' ' 54' ' ' ALA . 61.4 ttp180 -75.07 -50.47 16.33 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 110.063 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.94 -33.78 70.99 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.379 -0.826 . . . . 0.0 110.307 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -46.97 26.25 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.359 -0.838 . . . . 0.0 110.058 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.594 ' C ' HD13 ' A' ' 16' ' ' LEU . 3.4 tm? -57.44 -41.55 80.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.396 -0.815 . . . . 0.0 110.185 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.32 -45.4 76.33 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.34 -0.85 . . . . 0.0 110.454 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -85.2 -23.42 28.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.27 -0.893 . . . . 0.0 110.495 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.584 ' HB3' HD11 ' A' ' 83' ' ' LEU . 6.2 m-20 -74.11 -65.24 0.87 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.303 -0.873 . . . . 0.0 110.419 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.698 HD13 HG13 ' A' ' 25' ' ' ILE . 24.1 mt -146.9 143.35 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.322 -0.862 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.57 ' O ' ' C ' ' A' ' 22' ' ' THR . 8.4 mttt -94.78 142.57 27.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.589 -0.695 . . . . 0.0 109.162 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.57 ' C ' ' O ' ' A' ' 21' ' ' LYS . 80.9 p -23.5 97.58 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.618 -0.676 . . . . 0.0 110.921 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.2 t -146.32 -176.02 5.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.628 -0.67 . . . . 0.0 110.38 -178.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' SER . 13.8 t80 -33.15 -37.98 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.963 -0.46 . . . . 0.0 111.941 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.698 HG13 HD13 ' A' ' 20' ' ' ILE . 45.3 mm -57.5 -65.56 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.99 -1.069 . . . . 0.0 109.859 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.457 ' CE ' HD12 ' A' ' 57' ' ' ILE . 11.4 mmt -75.73 -25.27 56.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.459 -0.776 . . . . 0.0 110.323 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -71.15 -54.51 10.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.414 -0.804 . . . . 0.0 110.412 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.88 -32.62 63.86 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.292 -0.88 . . . . 0.0 110.378 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.8 mtp -62.48 -44.31 96.69 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 110.326 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.555 HG21 ' HB2' ' A' ' 40' ' ' GLU . 69.6 mt -63.82 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.397 -0.814 . . . . 0.0 110.199 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.4 m -79.53 -25.12 41.78 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.34 -0.85 . . . . 0.0 110.328 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.96 -20.72 55.05 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.242 -0.911 . . . . 0.0 110.363 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.07 -13.48 3.07 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.672 ' C ' HD12 ' A' ' 35' ' ' LEU . 7.9 m-30 -54.17 -66.6 0.37 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.207 -1.172 . . . . 0.0 110.4 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.672 HD12 ' C ' ' A' ' 34' ' ' PHE . 6.3 mp -128.34 165.19 21.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.358 -0.839 . . . . 0.0 110.212 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.7 p -56.31 154.4 8.23 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.399 -0.813 . . . . 0.0 110.396 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ILE . . . . . 0.43 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.2 mp -77.16 -23.66 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.405 -0.81 . . . . 0.0 110.32 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.1 m -64.59 -37.34 87.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.384 -0.822 . . . . 0.0 110.169 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.478 ' OE1' HD23 ' A' ' 35' ' ' LEU . 38.0 tt0 -68.1 -25.58 65.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.257 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.555 ' HB2' HG21 ' A' ' 30' ' ' ILE . 1.7 tt0 -74.95 -31.88 61.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.302 -0.874 . . . . 0.0 110.412 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.76 -32.42 72.99 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.336 -0.853 . . . . 0.0 110.306 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.23 -40.09 78.13 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.363 -0.835 . . . . 0.0 110.11 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 1.005 HG11 HD13 ' A' ' 56' ' ' LEU . 83.9 t -59.36 -34.35 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.366 -0.834 . . . . 0.0 110.265 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.07 -30.75 6.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.502 -0.749 . . . . 0.0 111.04 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -145.2 20.25 1.57 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.218 -0.926 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.546 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 10.3 tt0 -79.92 -57.24 0.69 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.096 -1.003 . . . . 0.0 110.355 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.546 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 47.7 Cg_endo -72.99 170.26 20.21 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 O-C-N 123.347 1.183 . . . . 0.0 110.52 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.8 m -131.07 -41.8 1.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 1.5 mm100 -87.85 -162.38 0.81 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.362 -0.836 . . . . 0.0 110.224 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -71.46 -9.18 57.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.337 -0.852 . . . . 0.0 110.568 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -60.25 -17.51 42.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.544 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -50.94 -49.53 59.61 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.213 -0.929 . . . . 0.0 110.683 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.79 -61.82 1.7 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.894 . . . . 0.0 110.512 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.531 ' HB1' ' CD ' ' A' ' 13' ' ' ARG . . . -48.85 -39.6 26.3 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.498 -0.751 . . . . 0.0 111.036 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 ttm -65.34 -45.2 85.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 1.005 HD13 HG11 ' A' ' 43' ' ' VAL . 14.8 tp -59.25 -34.84 72.7 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.362 -0.836 . . . . 0.0 110.714 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.691 ' HA ' HD12 ' A' ' 60' ' ' ILE . 6.8 mm -61.19 -36.12 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 110.482 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -45.52 93.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.176 -0.953 . . . . 0.0 110.043 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.41 -28.86 46.62 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.287 -0.883 . . . . 0.0 110.463 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 57' ' ' ILE . 86.6 mt -65.82 -54.69 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.39 -0.819 . . . . 0.0 109.841 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -79.35 -30.31 42.59 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.468 -0.77 . . . . 0.0 110.715 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -58.96 -25.01 63.16 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.284 -0.885 . . . . 0.0 110.611 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.64 ' HB2' HD11 ' A' ' 35' ' ' LEU . 11.4 tttt -72.61 -65.29 0.81 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.312 -0.868 . . . . 0.0 110.367 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -160.25 170.12 21.79 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.271 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -75.47 -29.81 59.71 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.371 -0.831 . . . . 0.0 110.128 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -62.84 -33.75 75.89 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.357 -0.839 . . . . 0.0 110.309 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 t -60.2 -26.85 66.69 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.37 -0.831 . . . . 0.0 110.159 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.718 ' HE1' HD23 ' A' ' 9' ' ' LEU . 13.8 t80 -75.86 -37.62 58.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.415 -0.803 . . . . 0.0 110.111 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -70.5 -37.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.895 . . . . 0.0 110.164 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.0 t -69.04 -37.66 78.69 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.324 -0.86 . . . . 0.0 110.279 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.479 ' HE2' HD22 ' A' ' 87' ' ' LEU . 5.8 t80 -54.99 -40.77 70.43 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.266 -0.896 . . . . 0.0 109.879 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.528 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 29.1 t80 -61.71 -38.94 89.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.308 -0.87 . . . . 0.0 109.947 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -78.27 -23.8 47.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.388 -0.82 . . . . 0.0 110.482 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.2 81.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.265 -0.897 . . . . 0.0 110.367 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.0 mt -77.78 -37.33 49.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.344 -0.847 . . . . 0.0 110.114 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.528 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 39.6 mt -65.84 -15.05 62.54 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.453 -0.78 . . . . 0.0 110.467 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -63.4 -31.85 73.12 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -100.75 -75.68 0.58 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.26 -0.9 . . . . 0.0 110.519 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.26 35.31 0.1 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -94.71 16.01 16.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.445 -1.032 . . . . 0.0 110.484 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 26.9 tttt -47.79 -31.36 4.81 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.342 -0.849 . . . . 0.0 110.677 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.62 -54.47 23.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.405 -0.809 . . . . 0.0 109.807 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.584 HD11 ' HB3' ' A' ' 19' ' ' ASP . 5.6 tt -73.22 -41.19 64.02 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.411 -0.806 . . . . 0.0 109.928 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.93 82.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.42 -0.8 . . . . 0.0 109.924 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -61.25 -35.18 76.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.389 -0.82 . . . . 0.0 110.126 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.39 -42.22 91.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.331 -0.856 . . . . 0.0 110.23 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.479 HD22 ' HE2' ' A' ' 71' ' ' PHE . 0.9 OUTLIER -71.41 -42.81 67.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.409 -0.807 . . . . 0.0 110.232 -179.949 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.727 ' HA ' HD12 ' A' ' 91' ' ' ILE . 21.1 t60 -66.03 -32.92 74.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.385 -0.822 . . . . 0.0 110.305 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.19 -14.84 63.29 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.372 -0.83 . . . . 0.0 110.587 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -108.55 -3.73 32.59 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.727 HD12 ' HA ' ' A' ' 88' ' ' HIS . 19.3 mt -67.49 -54.98 15.97 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.046 -1.267 . . . . 0.0 110.375 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.542 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo -70.74 -83.15 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 O-C-N 123.319 1.168 . . . . 0.0 110.65 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.525 HG12 ' H ' ' A' ' 95' ' ' SER . 58.0 t -128.93 154.81 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.113 -0.992 . . . . 0.0 110.162 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -111.55 -10.66 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 110.581 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.525 ' H ' HG12 ' A' ' 93' ' ' VAL . 26.9 t -56.37 -56.69 18.0 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.2 -0.937 . . . . 0.0 110.37 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.3 t -136.14 -69.64 0.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.345 -0.847 . . . . 0.0 110.282 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.261 179.977 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.172 0.51 . . . . 0.0 110.186 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -115.73 149.08 39.02 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.391 -0.818 . . . . 0.0 110.194 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.86 -24.95 65.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.369 -0.832 . . . . 0.0 110.289 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' CE ' HG23 ' A' ' 94' ' ' VAL . 40.3 tttp -64.78 -43.93 91.65 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 110.291 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.63 85.45 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -62.53 -46.32 88.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.331 -0.856 . . . . 0.0 109.747 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -25.48 67.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.775 . . . . 0.0 110.125 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.5 t -58.77 -59.28 5.67 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.805 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -60.29 -38.49 83.77 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.383 -0.823 . . . . 0.0 109.82 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 28.9 mt -63.24 -29.33 70.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.723 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -99.66 14.74 29.05 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.541 -0.725 . . . . 0.0 110.257 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.503 ' CE1' HD21 ' A' ' 87' ' ' LEU . 29.3 t-80 -97.83 25.49 5.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.243 -0.91 . . . . 0.0 110.171 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 ttp-105 -72.31 -50.05 29.89 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.426 -0.796 . . . . 0.0 110.104 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -63.13 -27.05 69.12 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.29 -45.48 12.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.321 -0.862 . . . . 0.0 110.322 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 16' ' ' LEU . 2.8 tm? -64.32 -48.4 75.76 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.277 -0.889 . . . . 0.0 109.735 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -64.58 -33.27 75.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.369 -0.832 . . . . 0.0 110.125 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -82.93 -27.32 30.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.344 -0.848 . . . . 0.0 110.123 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.669 ' HB3' HD11 ' A' ' 83' ' ' LEU . 57.2 m-20 -84.2 -63.65 1.3 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -0.831 . . . . 0.0 110.145 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.666 HD13 HG13 ' A' ' 25' ' ' ILE . 27.3 mt -136.11 109.78 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.605 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.564 ' O ' ' C ' ' A' ' 22' ' ' THR . 6.6 mttt -62.15 142.69 57.48 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.353 -0.842 . . . . 0.0 109.241 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.772 HG21 ' HG2' ' A' ' 52' ' ' ARG . 11.7 p -23.62 97.64 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.677 0.751 . . . . 0.0 111.29 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 17.9 t -141.98 -176.28 4.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.665 -0.647 . . . . 0.0 110.316 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 16.4 t80 -33.42 -38.05 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.899 -0.5 . . . . 0.0 111.842 -179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.666 HG13 HD13 ' A' ' 20' ' ' ILE . 43.3 mm -58.87 -60.17 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.024 -1.047 . . . . 0.0 109.948 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.587 ' SD ' HD11 ' A' ' 60' ' ' ILE . 7.9 mmt -75.35 -28.04 59.43 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.324 -0.86 . . . . 0.0 110.233 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -74.78 -60.46 2.27 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.324 -0.86 . . . . 0.0 110.51 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -58.35 -25.78 62.38 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.386 -0.821 . . . . 0.0 110.624 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 ttt -70.6 -49.56 46.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.31 -0.869 . . . . 0.0 110.389 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.828 HD11 HD11 ' A' ' 56' ' ' LEU . 69.2 mt -60.01 -31.24 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.304 -0.872 . . . . 0.0 110.152 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 24.7 m -77.91 -14.98 59.36 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.434 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.07 -25.44 45.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.219 -0.926 . . . . 0.0 110.468 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.16 -11.48 3.85 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.538 ' CB ' HD12 ' A' ' 35' ' ' LEU . 23.1 m-85 -58.43 -58.63 7.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.125 -1.22 . . . . 0.0 110.308 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HB2' HG23 ' A' ' 30' ' ' ILE . 5.3 mp -116.04 163.3 16.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.361 -0.837 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -59.74 148.16 35.23 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.378 -0.826 . . . . 0.0 110.41 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 71.9 mt -69.75 -20.6 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.431 -0.793 . . . . 0.0 110.239 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -58.02 -27.35 63.46 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.306 -0.871 . . . . 0.0 110.28 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -67.14 -33.77 76.14 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 110.128 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -59.81 -37.5 79.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.361 -0.837 . . . . 0.0 110.206 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -68.68 -30.22 68.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.347 -0.846 . . . . 0.0 110.101 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -76.42 -57.86 3.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.388 -0.82 . . . . 0.0 110.048 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 66.8 t -48.99 -33.92 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.409 -0.807 . . . . 0.0 110.647 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -48.83 -40.93 31.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.456 -0.777 . . . . 0.0 111.312 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -145.22 18.59 1.56 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.117 -0.989 . . . . 0.0 111.178 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.626 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -81.1 -48.49 1.07 Allowed Pre-proline 0 N--CA 1.493 1.698 0 O-C-N 121.021 -1.049 . . . . 0.0 110.71 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.626 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.7 Cg_endo -77.0 170.15 20.32 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 O-C-N 123.182 1.096 . . . . 0.0 110.291 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -134.16 -46.52 0.77 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.321 -0.862 . . . . 0.0 110.135 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -90.14 -155.34 0.37 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.09 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -76.38 -3.28 36.12 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.254 -0.904 . . . . 0.0 110.674 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -59.91 -17.56 38.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.129 -0.982 . . . . 0.0 110.553 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.772 ' HG2' HG21 ' A' ' 22' ' ' THR . 69.2 ttt180 -51.55 -43.51 62.38 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.29 -0.881 . . . . 0.0 110.621 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.23 -7.69 57.62 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.277 -0.89 . . . . 0.0 110.599 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.02 -45.01 12.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.07 -1.019 . . . . 0.0 110.021 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.0 tpp -76.44 -33.39 58.76 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.38 -0.825 . . . . 0.0 109.912 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.828 HD11 HD11 ' A' ' 30' ' ' ILE . 1.1 tm? -61.17 -44.07 97.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.445 -0.784 . . . . 0.0 109.878 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.551 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -64.17 -45.89 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.388 -0.82 . . . . 0.0 109.73 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.8 mttp -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.298 -0.876 . . . . 0.0 109.855 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.8 mmt -59.84 -35.37 74.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.301 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.587 HD11 ' SD ' ' A' ' 26' ' ' MET . 96.7 mt -59.87 -52.77 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.401 -0.812 . . . . 0.0 110.121 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.28 -36.23 58.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.334 -0.854 . . . . 0.0 110.705 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -25.5 59.45 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.247 -0.908 . . . . 0.0 110.606 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -84.98 -64.94 1.07 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.87 165.22 34.7 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.266 -0.896 . . . . 0.0 110.226 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -85.13 -22.09 28.99 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.481 -0.762 . . . . 0.0 110.318 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -56.48 -32.79 65.35 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.403 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 21.7 t -73.14 -32.44 64.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.381 -0.824 . . . . 0.0 110.154 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.805 ' CE1' HD23 ' A' ' 9' ' ' LEU . 9.3 t80 -63.55 -46.46 85.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.02 -43.91 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.019 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -62.53 -36.37 82.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.363 -0.836 . . . . 0.0 110.111 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.426 ' CE1' HD11 ' A' ' 75' ' ' LEU . 5.9 t80 -53.58 -36.85 62.37 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.327 -0.858 . . . . 0.0 109.693 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.619 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.7 t80 -63.68 -43.27 97.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.436 -0.79 . . . . 0.0 109.827 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -76.56 -27.45 55.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.391 -0.818 . . . . 0.0 110.375 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.66 -51.49 69.15 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.287 -0.883 . . . . 0.0 110.26 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.631 HD21 ' CG2' ' A' ' 25' ' ' ILE . 68.3 mt -65.7 -38.78 90.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.422 -0.799 . . . . 0.0 110.239 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.619 HD11 ' CE1' ' A' ' 72' ' ' TYR . 58.6 mt -67.01 -14.99 63.44 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.347 -0.845 . . . . 0.0 110.482 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -56.94 -25.08 57.05 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.219 -0.925 . . . . 0.0 110.479 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.68 -75.01 0.61 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.314 -0.866 . . . . 0.0 110.375 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.71 60.43 0.15 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -114.36 16.32 17.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -1.04 . . . . 0.0 110.504 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -44.84 -30.05 0.91 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.39 -0.818 . . . . 0.0 110.781 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -67.84 -60.24 2.67 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.319 -0.863 . . . . 0.0 109.732 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 83' ' ' LEU . 5.2 tt -69.77 -37.47 76.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.371 -0.831 . . . . 0.0 109.892 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.471 ' CB ' HD21 ' A' ' 76' ' ' LEU . . . -62.09 -29.58 70.42 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.378 -0.826 . . . . 0.0 110.039 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.15 71.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.431 -0.793 . . . . 0.0 110.014 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.62 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -59.16 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.33 -0.857 . . . . 0.0 109.656 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.503 HD21 ' CE1' ' A' ' 12' ' ' HIS . 1.1 mt -72.61 -37.96 67.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.39 -0.819 . . . . 0.0 110.176 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.451 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 21.6 t-160 -60.73 -51.03 71.08 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.407 -0.808 . . . . 0.0 110.258 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.55 -20.01 52.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.325 -0.859 . . . . 0.0 110.326 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.51 2.13 70.13 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.649 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 8.6 mm -76.87 -57.94 1.12 Allowed Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.027 -1.278 . . . . 0.0 110.142 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.649 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.5 Cg_endo -73.74 -82.33 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.256 0 O-C-N 123.207 1.109 . . . . 0.0 110.434 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.486 HG12 ' N ' ' A' ' 94' ' ' VAL . 59.8 t -147.37 167.68 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.066 -1.021 . . . . 0.0 109.862 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.486 ' N ' HG12 ' A' ' 93' ' ' VAL . 83.6 t -68.48 -63.43 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.291 -0.881 . . . . 0.0 109.973 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.5 t -159.76 -71.16 0.08 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.4 -0.813 . . . . 0.0 110.142 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.4 m -123.12 -46.89 2.05 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.433 -0.792 . . . . 0.0 110.188 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.196 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.19 0.519 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.52 107.96 1.53 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.342 -0.849 . . . . 0.0 110.192 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.12 -24.58 58.07 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.314 -0.866 . . . . 0.0 110.309 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 ttmm -51.92 -33.61 38.0 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.291 -0.881 . . . . 0.0 110.71 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.403 ' HA ' ' HA ' ' A' ' 91' ' ' ILE . . . -67.63 -36.33 80.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.227 -0.92 . . . . 0.0 110.139 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.702 ' HG3' HD12 ' A' ' 61' ' ' LEU . 24.1 ttt180 -69.83 -30.34 67.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.399 -0.813 . . . . 0.0 109.969 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 0.504 ' HA ' HD12 ' A' ' 10' ' ' LEU . 92.6 m-20 -73.56 -28.92 62.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.394 -0.816 . . . . 0.0 110.172 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -62.56 -51.35 67.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 110.091 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.803 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.8 tm? -60.36 -34.64 74.15 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.344 -0.847 . . . . 0.0 109.843 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 7' ' ' ASN . 53.4 mt -62.6 -30.21 71.17 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.357 -0.839 . . . . 0.0 109.958 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -91.58 13.16 18.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.365 -0.834 . . . . 0.0 110.457 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CG ' HD21 ' A' ' 87' ' ' LEU . 42.7 t60 -96.02 22.34 7.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.283 -0.886 . . . . 0.0 110.2 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -75.35 -57.54 3.83 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.259 -0.901 . . . . 0.0 110.452 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.19 -35.12 73.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.375 -0.828 . . . . 0.0 110.49 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.49 -49.7 21.15 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.848 . . . . 0.0 110.166 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.663 HD13 ' CG1' ' A' ' 57' ' ' ILE . 7.8 tt -62.09 -32.44 72.99 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.404 -0.81 . . . . 0.0 110.255 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.01 -52.06 65.54 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.425 -0.797 . . . . 0.0 110.384 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -85.07 -25.16 27.75 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.336 -0.853 . . . . 0.0 110.48 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.612 ' HB3' HD11 ' A' ' 83' ' ' LEU . 78.9 m-20 -85.35 -65.39 1.02 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.238 -0.914 . . . . 0.0 110.773 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.9 mm -117.09 109.63 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.228 -0.92 . . . . 0.0 110.599 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.0 mttt -96.93 141.68 29.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.461 -0.774 . . . . 0.0 109.156 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.775 HG22 HD22 ' A' ' 56' ' ' LEU . 75.8 p -24.39 97.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.681 -0.637 . . . . 0.0 111.202 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 24' ' ' TYR . 41.8 t -156.78 -176.72 6.13 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.603 -0.685 . . . . 0.0 110.357 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.441 ' C ' ' O ' ' A' ' 23' ' ' SER . 14.8 t80 -33.63 -44.5 0.15 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.875 -0.515 . . . . 0.0 111.775 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.57 -52.59 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 120.963 -1.086 . . . . 0.0 109.893 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' MET . . . . . 0.521 ' HB3' HD21 ' A' ' 56' ' ' LEU . 6.9 mmt -75.38 -47.13 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.454 -0.779 . . . . 0.0 110.306 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.42 -62.17 2.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.421 -0.8 . . . . 0.0 110.793 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -53.01 -36.93 61.04 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.219 -0.926 . . . . 0.0 110.84 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' MET . . . . . 0.435 ' HG2' ' CE2' ' A' ' 34' ' ' PHE . 20.9 ttp -66.61 -42.82 86.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.278 -0.889 . . . . 0.0 110.342 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.4 HG13 ' CE ' ' A' ' 29' ' ' MET . 67.5 mt -72.47 -47.31 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.288 -0.882 . . . . 0.0 110.183 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.4 m -63.04 -18.61 63.53 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.283 -0.886 . . . . 0.0 110.48 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.31 -20.04 39.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.193 -0.942 . . . . 0.0 110.535 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.75 -5.05 5.46 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.435 ' CE2' ' HG2' ' A' ' 29' ' ' MET . 7.4 m-30 -55.82 -54.89 39.04 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.136 -1.214 . . . . 0.0 110.395 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.64 HD21 ' HB2' ' A' ' 63' ' ' LYS . 1.1 mp -129.07 165.11 21.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.365 -0.835 . . . . 0.0 110.077 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.9 p -56.85 145.17 30.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.378 -0.826 . . . . 0.0 110.492 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.4 mt -61.76 -23.89 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.432 -0.792 . . . . 0.0 110.28 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.9 m -59.36 -26.3 64.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.265 -0.897 . . . . 0.0 110.371 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.02 -46.64 83.56 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.273 -0.892 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.06 -32.43 73.8 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.398 -0.814 . . . . 0.0 110.157 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -64.89 -27.53 68.92 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt -84.85 -59.68 2.28 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.389 -0.82 . . . . 0.0 110.33 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 1.02 HG11 HD13 ' A' ' 56' ' ' LEU . 58.4 t -48.14 -33.89 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.432 -0.793 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -47.82 -40.78 22.14 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.409 -0.807 . . . . 0.0 111.14 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.2 18.27 1.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.868 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.612 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.3 tm-20 -81.98 -48.16 0.95 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.108 -0.995 . . . . 0.0 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.612 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.4 Cg_endo -76.05 169.94 21.1 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.186 1.098 . . . . 0.0 110.359 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.5 m -128.6 -40.09 1.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 110.345 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -154.35 0.51 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.15 -12.59 41.31 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.25 -0.906 . . . . 0.0 110.83 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -51.75 -24.52 5.98 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.114 -0.991 . . . . 0.0 110.686 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.447 ' CD ' HG21 ' A' ' 22' ' ' THR . 29.4 ttm180 -55.27 -40.13 70.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.26 -0.9 . . . . 0.0 110.322 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.47 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -81.08 -11.54 59.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -0.874 . . . . 0.0 110.469 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.43 -47.76 9.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.988 . . . . 0.0 110.261 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.5 ttt -71.81 -37.85 70.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.84 . . . . 0.0 110.378 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 1.02 HD13 HG11 ' A' ' 43' ' ' VAL . 13.0 tp -60.36 -46.34 90.29 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.257 -0.902 . . . . 0.0 110.306 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.663 ' CG1' HD13 ' A' ' 16' ' ' LEU . 1.3 mp -72.51 -39.12 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.837 . . . . 0.0 109.987 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -64.49 -37.29 87.02 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.712 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.36 -31.35 70.24 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 109.939 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' A' ' 57' ' ' ILE . 97.1 mt -60.77 -54.74 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.407 -0.808 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.702 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.93 -27.69 64.97 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 110.601 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -67.68 -29.09 68.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.244 -0.91 . . . . 0.0 110.342 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.64 ' HB2' HD21 ' A' ' 35' ' ' LEU . 1.3 tmtt? -72.74 -64.97 0.85 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.257 -0.902 . . . . 0.0 110.235 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -160.09 166.7 29.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.391 -0.818 . . . . 0.0 110.182 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -81.05 -25.5 37.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.442 -0.786 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -62.27 -34.01 75.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.13 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -59.65 -37.93 80.06 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.376 -0.827 . . . . 0.0 110.012 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.803 ' CE1' HD23 ' A' ' 9' ' ' LEU . 10.4 t80 -66.39 -34.3 77.65 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 109.84 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.6 t -72.69 -40.46 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.0 110.05 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -67.06 -43.45 82.66 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.436 -0.79 . . . . 0.0 110.022 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.726 ' CE1' HD11 ' A' ' 75' ' ' LEU . 1.1 t80 -55.15 -29.89 58.72 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.38 -0.825 . . . . 0.0 109.789 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.678 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 26.9 t80 -67.57 -39.64 84.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.355 -0.841 . . . . 0.0 109.939 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -76.51 -34.52 58.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.414 -0.804 . . . . 0.0 110.308 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.8 -31.98 70.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.336 -0.853 . . . . 0.0 110.33 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.726 HD11 ' CE1' ' A' ' 71' ' ' PHE . 36.9 mt -82.88 -37.35 24.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.313 -0.867 . . . . 0.0 110.279 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.678 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 20.7 mt -70.13 -14.88 62.85 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.388 -0.82 . . . . 0.0 110.477 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -70.49 -23.1 62.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.098 -1.001 . . . . 0.0 110.742 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -106.26 -75.49 0.63 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.21 -0.931 . . . . 0.0 110.559 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.31 35.98 0.1 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -100.46 16.04 25.91 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.502 -0.999 . . . . 0.0 110.51 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 45.4 tttt -46.75 -31.78 3.19 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.352 -0.843 . . . . 0.0 110.711 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -67.07 -51.57 52.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.87 . . . . 0.0 109.694 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.612 HD11 ' HB3' ' A' ' 19' ' ' ASP . 4.9 tt -71.14 -48.79 49.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 109.99 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -57.9 -34.92 70.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.417 -0.802 . . . . 0.0 110.312 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.75 -36.02 77.85 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.364 -0.835 . . . . 0.0 110.029 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 0.421 HD23 ' C ' ' A' ' 86' ' ' LEU . 10.0 tt -62.43 -36.5 82.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.422 -0.799 . . . . 0.0 110.288 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.45 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.1 mt -80.83 -29.87 35.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.367 -0.833 . . . . 0.0 110.351 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.873 ' HA ' HD12 ' A' ' 91' ' ' ILE . 57.1 t-80 -75.31 -55.21 5.93 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.393 -0.817 . . . . 0.0 110.494 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.16 -19.13 52.42 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.289 -0.882 . . . . 0.0 110.588 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.86 -22.82 48.2 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.873 HD12 ' HA ' ' A' ' 88' ' ' HIS . 16.7 mt -56.94 -53.76 61.6 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.269 -1.136 . . . . 0.0 110.684 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.577 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 46.1 Cg_endo -73.09 -53.29 0.13 Allowed 'Trans proline' 0 C--N 1.312 -1.353 0 O-C-N 123.289 1.152 . . . . 0.0 110.735 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.403 HG23 ' C ' ' A' ' 92' ' ' PRO . 53.5 t -144.93 149.21 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.367 -0.833 . . . . 0.0 110.027 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.4 t -53.91 -63.56 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.356 -0.84 . . . . 0.0 110.334 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.2 t -164.31 -71.99 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.36 -0.837 . . . . 0.0 110.288 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.84 -62.78 0.84 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.378 -0.826 . . . . 0.0 110.25 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.243 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.152 0.501 . . . . 0.0 110.102 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -140.8 136.48 32.49 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.359 -0.838 . . . . 0.0 110.36 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.72 -24.45 63.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.376 -0.827 . . . . 0.0 110.116 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -49.44 -37.05 24.34 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.39 -0.819 . . . . 0.0 110.707 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.15 99.34 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.355 -0.84 . . . . 0.0 110.111 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ARG . . . . . 0.511 ' NH1' HD11 ' A' ' 10' ' ' LEU . 5.8 ttp85 -65.78 -32.88 74.66 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.348 -0.845 . . . . 0.0 110.126 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -75.4 -25.0 57.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.321 -0.862 . . . . 0.0 110.143 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -62.23 -50.41 71.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.271 -0.893 . . . . 0.0 110.123 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.954 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -64.81 -36.42 84.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 ' NH1' ' A' ' 6' ' ' ARG . 50.8 mt -68.73 -31.61 70.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.428 -0.795 . . . . 0.0 109.909 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -96.84 27.7 3.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.415 -0.803 . . . . 0.0 110.01 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 50.8 t-80 -112.07 36.57 3.29 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.803 . . . . 0.0 110.079 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.424 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 35.7 ttp180 -75.07 -64.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.497 -0.752 . . . . 0.0 110.297 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.83 -27.64 69.02 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.387 -0.821 . . . . 0.0 110.221 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.86 -50.24 74.24 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 110.317 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 19' ' ' ASP . 0.7 OUTLIER -75.09 -26.25 59.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 110.533 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.25 -46.06 54.57 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.264 -0.898 . . . . 0.0 110.64 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -85.25 -22.37 28.66 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.421 -0.799 . . . . 0.0 110.531 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . 69.5 m-20 -85.02 -64.99 1.06 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.701 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.83 HD13 HG13 ' A' ' 25' ' ' ILE . 43.4 mt -131.4 164.87 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.154 -0.966 . . . . 0.0 111.045 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.581 ' O ' ' C ' ' A' ' 22' ' ' THR . 15.6 mmtp -131.84 142.86 49.83 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.581 ' C ' ' O ' ' A' ' 21' ' ' LYS . 71.9 p -23.15 96.03 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 121.641 0.734 . . . . 0.0 110.993 -179.158 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' SER . . . . . 0.456 ' O ' ' C ' ' A' ' 24' ' ' TYR . 65.2 p -155.84 -175.5 5.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.69 -0.631 . . . . 0.0 110.089 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 0.456 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.8 t80 -32.59 -40.68 0.05 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.751 -0.593 . . . . 0.0 111.805 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.83 HG13 HD13 ' A' ' 20' ' ' ILE . 42.5 mm -55.56 -60.5 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.94 -1.1 . . . . 0.0 109.541 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.53 -34.96 60.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.404 -0.81 . . . . 0.0 110.092 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -67.32 -61.33 1.97 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.392 -0.818 . . . . 0.0 110.375 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -53.02 -24.98 10.86 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.274 -0.891 . . . . 0.0 110.456 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.1 mmt -78.16 -34.37 49.74 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.341 -0.849 . . . . 0.0 110.226 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.996 HD11 HD21 ' A' ' 56' ' ' LEU . 73.1 mt -81.96 -43.5 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -66.8 -19.82 65.82 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.36 -0.837 . . . . 0.0 110.485 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.69 -20.29 47.22 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.262 -0.899 . . . . 0.0 110.436 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.96 -6.25 4.75 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 0.422 ' HB2' ' HA ' ' A' ' 30' ' ' ILE . 8.7 m-30 -53.68 -58.41 7.3 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.102 -1.234 . . . . 0.0 110.454 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 63' ' ' LYS . 1.2 mt -132.03 165.06 24.84 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.303 -0.873 . . . . 0.0 110.292 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.4 p -55.48 144.31 26.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.375 -0.828 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.8 mt -74.37 -25.33 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 110.116 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -59.26 -46.1 89.43 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.378 -0.826 . . . . 0.0 110.364 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.72 -32.78 74.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.342 -0.849 . . . . 0.0 110.119 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -63.27 -45.71 90.23 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.816 . . . . 0.0 110.049 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.76 -29.94 60.45 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.375 -0.828 . . . . 0.0 110.114 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 26.0 ttmt -62.86 -54.72 34.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.428 -0.795 . . . . 0.0 109.946 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.2 t -44.7 -33.73 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.572 -0.705 . . . . 0.0 110.557 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -49.24 -33.76 13.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.552 -0.717 . . . . 0.0 111.291 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -145.35 14.09 1.42 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.052 -1.03 . . . . 0.0 111.628 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.5 tm-20 -82.05 -48.61 0.92 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 120.878 -1.139 . . . . 0.0 110.959 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.9 Cg_endo -77.97 160.19 30.46 Favored 'Trans proline' 0 C--N 1.314 -1.277 0 O-C-N 123.376 1.198 . . . . 0.0 110.709 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 49.3 m -126.87 -32.24 2.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.49 -0.756 . . . . 0.0 110.282 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.414 ' CD ' ' H ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -106.05 -164.07 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.32 -0.863 . . . . 0.0 110.202 179.603 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -19.06 21.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.327 -0.858 . . . . 0.0 110.628 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -52.49 -21.54 3.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.225 -0.922 . . . . 0.0 110.666 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -50.36 -65.27 0.59 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.297 -0.877 . . . . 0.0 110.649 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.601 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -66.08 -47.52 74.0 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.385 -0.822 . . . . 0.0 109.913 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.424 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -52.17 -33.56 41.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.354 -0.841 . . . . 0.0 110.394 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.3 ttt -81.31 -26.49 35.63 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.109 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.996 HD21 HD11 ' A' ' 30' ' ' ILE . 5.4 tt -73.05 -50.81 20.84 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.338 -0.851 . . . . 0.0 110.171 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.601 HD12 ' O ' ' A' ' 53' ' ' ALA . 3.1 mp -62.56 -37.57 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.399 -0.813 . . . . 0.0 109.913 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -37.35 84.09 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.268 -0.895 . . . . 0.0 109.634 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 28.5 mmm -60.94 -30.18 70.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.825 . . . . 0.0 110.102 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 57' ' ' ILE . 93.2 mt -62.32 -46.26 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.407 -0.808 . . . . 0.0 109.917 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.426 HD21 ' HG ' ' A' ' 9' ' ' LEU . 1.9 mm? -73.52 -28.64 62.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.438 -0.789 . . . . 0.0 110.547 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -40.16 94.63 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.465 ' HB2' HD21 ' A' ' 35' ' ' LEU . 11.5 tttm -61.38 -65.47 0.69 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.301 -0.874 . . . . 0.0 110.315 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.42 170.03 21.83 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.373 -0.829 . . . . 0.0 110.293 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -80.02 -30.12 39.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.383 -0.823 . . . . 0.0 110.142 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -62.38 -27.73 69.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.399 -0.813 . . . . 0.0 110.184 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . 0.403 ' OG ' ' CD2' ' A' ' 34' ' ' PHE . 2.9 t -62.85 -39.47 94.5 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.394 -0.816 . . . . 0.0 110.085 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.954 ' CE1' HD23 ' A' ' 9' ' ' LEU . 5.5 t80 -62.08 -39.61 93.01 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.418 -0.801 . . . . 0.0 110.015 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 63.5 t -64.9 -41.77 93.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.316 -0.865 . . . . 0.0 109.964 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 38.4 t -63.06 -37.35 86.85 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.388 -0.82 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.538 ' CE1' HD11 ' A' ' 75' ' ' LEU . 6.5 t80 -54.18 -35.96 62.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.371 -0.83 . . . . 0.0 109.767 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.691 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.4 t80 -63.59 -45.82 88.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.419 -0.8 . . . . 0.0 110.078 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -28.45 65.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.256 -0.903 . . . . 0.0 110.296 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.88 -55.64 30.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.3 -0.875 . . . . 0.0 110.419 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.538 HD11 ' CE1' ' A' ' 71' ' ' PHE . 11.9 mt -60.72 -35.96 77.63 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.374 -0.829 . . . . 0.0 110.39 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.691 HD11 ' CE1' ' A' ' 72' ' ' TYR . 30.3 mt -71.71 -14.98 62.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.446 -0.784 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -59.71 -33.06 71.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.194 -0.941 . . . . 0.0 110.656 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -105.52 -75.37 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -0.918 . . . . 0.0 110.392 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.95 35.22 0.1 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -95.68 16.32 17.65 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.36 -1.083 . . . . 0.0 110.311 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -45.0 -29.45 0.84 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.412 -0.805 . . . . 0.0 110.863 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.55 -50.17 72.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.269 -0.894 . . . . 0.0 109.757 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.656 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -74.56 -41.79 59.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.38 -0.825 . . . . 0.0 109.587 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.84 -32.47 73.69 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 109.999 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.98 -34.61 78.49 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.91 -46.73 87.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.301 -0.874 . . . . 0.0 110.455 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.8 mp -74.86 -47.41 30.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.336 -0.853 . . . . 0.0 110.332 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 67.8 t60 -59.85 -44.12 94.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.38 -0.825 . . . . 0.0 110.516 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -58.23 -20.64 43.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.329 -0.857 . . . . 0.0 110.534 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -107.08 14.15 40.52 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.63 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 7.8 mm -74.08 -57.12 2.42 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.259 . . . . 0.0 109.984 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.63 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo -72.9 -81.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.286 0 O-C-N 123.347 1.182 . . . . 0.0 110.476 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.403 HG12 ' N ' ' A' ' 94' ' ' VAL . 65.5 t -134.3 162.72 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.183 -0.948 . . . . 0.0 109.94 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 0.403 ' N ' HG12 ' A' ' 93' ' ' VAL . 85.1 t -94.27 -77.15 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.306 -0.871 . . . . 0.0 110.275 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 12.7 t -165.08 -41.62 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.215 -0.928 . . . . 0.0 110.261 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 13.4 p -60.44 -72.88 0.1 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.362 -0.836 . . . . 0.0 110.154 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.2 m . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.241 179.931 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.487 0.0 OUTLIER . . . . . 3 N--CA 1.082 -18.859 0 N-CA-C 115.254 1.576 . . . . 3.48 115.254 . . . . . . . . . 3 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ASP . . . . . 1.213 ' OD2' ' CB ' ' A' ' 2' ' ' ASP . 3.5 p30 -114.37 129.42 56.65 Favored 'General case' 1 C--N 1.131 -8.921 0 O-C-N 116.508 -3.87 . . . . 1.9199999999999999 113.191 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.19 -27.68 63.68 Favored 'General case' 0 C--N 1.282 -2.33 0 O-C-N 121.434 -0.791 . . . . 0.77000000000000002 110.335 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 1.248 ' CE ' ' CG ' ' A' ' 4' ' ' LYS . 10.3 tttt -57.31 -37.56 72.67 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.424 -0.797 . . . . 2.0600000000000001 110.491 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ALA . . . . . 0.433 ' HB2' ' OD1' ' A' ' 2' ' ' ASP . . . -62.48 -39.39 93.29 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.155 -0.966 . . . . 0.37 110.154 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -66.43 -33.45 75.74 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.29 -0.881 . . . . 2.5299999999999998 110.11 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ASN . . . . . 1.038 ' ND2' ' CB ' ' A' ' 7' ' ' ASN . 3.3 m-20 -72.82 -28.64 62.67 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.395 -0.816 . . . . 1.21 110.182 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 t -61.13 -55.13 36.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.418 -0.801 . . . . 0.64000000000000001 110.249 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.772 HD13 ' O ' ' A' ' 9' ' ' LEU . 1.2 tm? -59.24 -36.03 74.74 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.029 -1.044 . . . . 0.35999999999999999 110.034 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 66.5 mt -71.01 -28.72 64.62 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.42 -0.8 . . . . 0.68000000000000005 110.242 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 1.178 ' NE2' ' CG ' ' A' ' 11' ' ' GLN . 55.1 tt0 -100.15 20.06 15.28 Favored 'General case' 0 C--O 1.171 -3.037 0 CA-C-O 121.526 0.679 . . . . 2.1400000000000001 110.53 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' HIS . . . . . 0.918 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 6.1 t-80 -112.83 30.88 6.8 Favored 'General case' 0 C--N 1.262 -3.2 0 O-C-N 120.166 -1.584 . . . . 2.27 111.541 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ARG . . . . . 0.706 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 49.2 ttp180 -72.97 -43.92 61.69 Favored 'General case' 0 C--N 1.274 -2.679 0 O-C-N 121.292 -0.88 . . . . 2.1600000000000001 110.929 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 1.036 ' OE1' ' CG ' ' A' ' 14' ' ' GLU . 69.6 tt0 -62.25 -33.91 75.51 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.107 -0.995 . . . . 1.3100000000000001 110.455 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ALA . . . . . 0.918 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -78.43 -42.9 28.73 Favored 'General case' 0 C--O 1.195 -1.798 0 O-C-N 121.231 -0.918 . . . . 0.63 110.59 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' LEU . . . . . 1.306 ' CD2' ' CB ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.19 -38.93 86.22 Favored 'General case' 0 C--N 1.29 -1.995 0 O-C-N 121.1 -1.0 . . . . 1.49 110.152 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 1.058 ' OE1' ' CG ' ' A' ' 17' ' ' GLU . 60.2 tt0 -60.22 -41.99 94.21 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.466 -0.771 . . . . 1.73 110.638 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -78.11 -32.62 50.6 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.173 -0.954 . . . . 1.8400000000000001 110.575 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . 1.012 ' OD1' ' CB ' ' A' ' 19' ' ' ASP . 65.9 m-20 -82.75 -63.7 1.32 Allowed 'General case' 0 C--N 1.272 -2.768 0 O-C-N 120.337 -1.477 . . . . 1.3799999999999999 111.564 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ILE . . . . . 0.573 HD12 HG21 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -119.39 136.45 56.52 Favored 'Isoleucine or valine' 1 C--O 1.102 -6.689 0 O-C-N 120.73 -1.231 . . . . 1.04 112.225 -179.883 . . . . . . . . 4 4 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.68 ' O ' ' HB2' ' A' ' 23' ' ' SER . 88.5 mttt -112.85 141.99 46.03 Favored 'General case' 1 C--N 1.224 -4.851 0 O-C-N 116.772 -3.705 . . . . 1.95 109.125 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.625 HG21 ' HG2' ' A' ' 52' ' ' ARG . 75.7 p -24.2 97.41 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.505 0.669 . . . . 0.48999999999999999 111.212 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' SER . . . . . 1.073 ' OG ' ' CB ' ' A' ' 23' ' ' SER . 0.4 OUTLIER -156.33 -176.21 5.84 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.409 -0.807 . . . . 1.1100000000000001 110.233 -178.648 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TYR . . . . . 1.392 ' CZ ' ' CD2' ' A' ' 24' ' ' TYR . 12.8 t80 -33.23 -39.82 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.805 -0.559 . . . . 1.26 111.943 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ILE . . . . . 0.573 HG21 HD12 ' A' ' 20' ' ' ILE . 44.0 mm -55.74 -62.7 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 120.962 -1.086 . . . . 0.32000000000000001 110.079 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' MET . . . . . 1.279 ' SD ' ' CE ' ' A' ' 26' ' ' MET . 1.6 mmt -75.54 -38.03 59.59 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.313 -0.867 . . . . 1.21 110.473 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ASP . . . . . 1.044 ' OD1' ' CB ' ' A' ' 27' ' ' ASP . 5.0 t70 -61.03 -53.87 51.87 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 120.89 -1.131 . . . . 1.1799999999999999 110.705 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' HIS . . . . . 1.408 ' CG ' ' CE1' ' A' ' 28' ' ' HIS . 18.4 t-160 -57.05 -34.22 68.01 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.887 -1.133 . . . . 1.22 110.361 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' MET . . . . . 1.344 ' CE ' ' CB ' ' A' ' 29' ' ' MET . 2.8 mtt -68.51 -41.82 79.44 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 120.943 -1.098 . . . . 2.7000000000000002 110.411 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ILE . . . . . 0.597 HG23 ' HB2' ' A' ' 35' ' ' LEU . 86.1 mt -64.15 -42.9 97.02 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.169 0 O-C-N 120.91 -1.119 . . . . 0.91000000000000003 110.382 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.1 m -77.52 -18.81 56.66 Favored 'General case' 0 C--N 1.283 -2.32 0 O-C-N 120.496 -1.377 . . . . 0.58999999999999997 110.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASP . . . . . 1.097 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 4.9 t70 -58.9 -22.85 60.28 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.087 -1.008 . . . . 1.3200000000000001 110.453 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.82 -12.49 3.4 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.109 -1.196 . . . . 0.39000000000000001 110.109 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PHE . . . . . 1.387 ' CZ ' ' CD1' ' A' ' 34' ' ' PHE . 12.7 m-30 -59.42 -61.51 2.57 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.851 -1.382 . . . . 1.29 110.37 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' LEU . . . . . 1.291 ' CD1' ' CB ' ' A' ' 35' ' ' LEU . 5.6 mp -119.39 162.93 17.98 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.214 -0.929 . . . . 1.3799999999999999 110.558 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.9 p -61.52 157.7 16.6 Favored 'General case' 0 C--O 1.199 -1.603 0 O-C-N 121.201 -0.937 . . . . 0.59999999999999998 110.344 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.3 mt -75.97 -22.36 15.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.2 0 O-C-N 120.807 -1.183 . . . . 1.21 110.459 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 m -59.17 -30.05 67.9 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.308 -0.87 . . . . 0.68999999999999995 110.456 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -67.07 -31.9 72.71 Favored 'General case' 0 C--N 1.283 -2.308 0 O-C-N 121.176 -0.952 . . . . 1.78 110.712 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 1.163 ' CD ' ' CB ' ' A' ' 40' ' ' GLU . 7.4 tt0 -65.89 -38.8 89.71 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.956 0.884 . . . . 2.3199999999999998 110.406 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' GLU . . . . . 1.127 ' OE2' ' CG ' ' A' ' 41' ' ' GLU . 32.5 tt0 -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.277 -2.576 0 O-C-N 120.946 -1.096 . . . . 1.75 110.692 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 10.5 ttmt -75.99 -56.95 4.18 Favored 'General case' 0 C--N 1.283 -2.311 0 O-C-N 120.903 -1.123 . . . . 1.52 110.407 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.0 t -50.12 -33.78 9.99 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.495 -0.753 . . . . 0.51000000000000001 110.638 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -47.38 -40.4 17.53 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.564 -0.71 . . . . 2.8199999999999998 111.613 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . 1.202 ' OD1' ' CB ' ' A' ' 45' ' ' ASN . 2.4 t30 -143.72 16.59 1.8 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.026 -1.046 . . . . 1.3500000000000001 111.225 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLU . . . . . 1.273 ' CD ' ' CB ' ' A' ' 46' ' ' GLU . 1.4 tt0 -80.24 -50.88 1.11 Allowed Pre-proline 0 C--N 1.299 -1.606 0 O-C-N 120.867 -1.145 . . . . 2.52 110.893 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.746 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.4 Cg_endo -75.81 168.81 23.52 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 O-C-N 123.127 1.067 . . . . 0.57999999999999996 110.465 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.5 m -135.94 -42.21 0.66 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.47 -0.769 . . . . 0.84999999999999998 110.517 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 1.514 ' NE2' ' CG ' ' A' ' 49' ' ' GLN . 12.6 mm-40 -95.37 -159.05 0.69 Allowed 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.915 -1.116 . . . . 2.0099999999999998 110.063 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -65.74 -12.69 55.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.26 -0.9 . . . . 2.6099999999999999 110.952 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' GLN . . . . . 1.041 ' OE1' ' CG ' ' A' ' 51' ' ' GLN . 56.5 tt0 -56.36 -20.2 18.11 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.288 -0.882 . . . . 1.45 110.75 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 1.445 ' CD ' ' CZ ' ' A' ' 52' ' ' ARG . 45.5 ttt180 -51.44 -48.9 62.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.174 -0.954 . . . . 2.1099999999999999 110.752 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ALA . . . . . 0.637 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -77.3 -34.8 55.41 Favored 'General case' 1 C--O 1.147 -4.314 0 O-C-N 120.679 -1.263 . . . . 0.78000000000000003 110.318 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.706 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -63.15 -36.75 84.64 Favored 'General case' 1 C--N 1.241 -4.11 0 O-C-N 118.042 -2.911 . . . . 0.56999999999999995 110.666 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 55' ' ' MET . . . . . 1.393 ' CE ' ' CG ' ' A' ' 55' ' ' MET . 11.8 ttt -78.26 -34.54 48.97 Favored 'General case' 0 C--N 1.293 -1.858 0 O-C-N 121.194 -0.941 . . . . 1.76 110.246 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.3 tp -69.16 -41.58 77.06 Favored 'General case' 0 C--N 1.287 -2.152 0 O-C-N 120.616 -1.303 . . . . 0.82999999999999996 110.441 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.637 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -65.62 -37.37 79.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 O-C-N 121.1 -1.0 . . . . 0.59999999999999998 110.174 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -66.8 -39.91 87.93 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.044 -1.035 . . . . 1.3999999999999999 110.017 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' MET . . . . . 1.304 ' SD ' ' CE ' ' A' ' 59' ' ' MET . 5.6 mmt -58.62 -31.18 67.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.882 . . . . 1.4399999999999999 110.229 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' A' ' 57' ' ' ILE . 98.6 mt -63.59 -53.96 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.303 -0.873 . . . . 0.39000000000000001 109.938 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.459 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.0 mm? -75.24 -32.46 61.12 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.405 -0.809 . . . . 0.42999999999999999 110.672 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 1.47 ' CD ' ' NZ ' ' A' ' 62' ' ' LYS . 16.9 mmtt -61.19 -27.9 68.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.15 -0.969 . . . . 1.76 110.567 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 1.532 ' CG ' ' CE ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -73.43 -65.0 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.233 -0.917 . . . . 2.4700000000000002 110.363 -179.917 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 1.18 ' OD2' ' CB ' ' A' ' 64' ' ' ASP . 13.4 t0 -159.73 165.34 32.72 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.345 -0.847 . . . . 1.75 110.211 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASN . . . . . 0.997 ' ND2' ' CB ' ' A' ' 65' ' ' ASN . 2.7 m-20 -80.07 -26.4 39.66 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.287 -0.883 . . . . 0.98999999999999999 110.32 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASP . . . . . 0.997 ' OD2' ' CB ' ' A' ' 66' ' ' ASP . 12.4 m-20 -61.43 -35.36 77.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.876 . . . . 1.24 110.347 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.4 t -62.59 -34.57 77.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.274 -0.891 . . . . 0.46999999999999997 110.162 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 1.395 ' CZ ' ' CD2' ' A' ' 68' ' ' TYR . 19.3 t80 -64.33 -38.53 91.37 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.211 -0.931 . . . . 1.26 110.068 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.7 t -68.0 -39.32 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.281 -0.887 . . . . 0.32000000000000001 110.052 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -66.78 -36.53 82.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.23 -0.919 . . . . 0.27000000000000002 110.054 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 1.426 ' CZ ' ' CD1' ' A' ' 71' ' ' PHE . 1.2 t80 -55.43 -37.43 67.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.288 -0.882 . . . . 1.24 109.886 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 1.367 ' CG ' ' CE2' ' A' ' 72' ' ' TYR . 44.8 t80 -64.41 -43.85 93.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 1.25 110.104 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASN . . . . . 1.011 ' ND2' ' CB ' ' A' ' 73' ' ' ASN . 8.9 t30 -75.44 -26.73 58.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.271 -0.893 . . . . 1.01 110.463 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.03 94.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.93 . . . . 0.32000000000000001 110.338 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' LEU . . . . . 0.449 HD11 ' CZ ' ' A' ' 71' ' ' PHE . 16.8 mt -75.26 -38.44 60.47 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.949 -1.095 . . . . 0.40000000000000002 110.274 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.735 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.9 mt -67.25 -15.13 63.52 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.405 -0.809 . . . . 0.41999999999999998 110.554 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' HIS . . . . . 1.387 ' CG ' ' CE1' ' A' ' 77' ' ' HIS . 3.5 t-80 -62.32 -24.7 67.47 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 1.24 110.751 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLU . . . . . 1.447 ' OE1' ' CG ' ' A' ' 78' ' ' GLU . 28.0 mt-10 -109.74 -75.21 0.63 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.172 -0.955 . . . . 1.5900000000000001 110.414 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.89 47.77 0.15 Allowed Glycine 0 C--O 1.187 -2.791 0 N-CA-C 109.438 -1.465 . . . . 0.55000000000000004 109.438 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' TYR . . . . . 1.409 ' CG ' ' CE2' ' A' ' 80' ' ' TYR . 34.6 m-85 -106.16 16.22 25.23 Favored 'General case' 0 C--N 1.276 -2.599 0 O-C-N 120.029 -1.865 . . . . 1.3799999999999999 110.534 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . 1.423 ' CD ' ' NZ ' ' A' ' 81' ' ' LYS . 46.6 tttt -44.88 -31.59 1.3 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.424 -0.797 . . . . 1.6699999999999999 110.953 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . 1.005 ' OD1' ' CB ' ' A' ' 82' ' ' ASP . 2.7 m-20 -68.34 -51.98 38.38 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 1.26 109.9 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.413 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -72.12 -44.12 63.65 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.048 -1.033 . . . . 1.52 110.174 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.02 -35.06 74.25 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.405 -0.81 . . . . 0.46000000000000002 110.228 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -62.43 -36.0 81.02 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.306 -0.871 . . . . 0.5 110.169 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 86' ' ' LEU . . . . . 1.284 ' CD2' ' CB ' ' A' ' 86' ' ' LEU . 9.1 tp -60.31 -43.54 96.25 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.35 -0.844 . . . . 1.5900000000000001 110.368 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' LEU . . . . . 0.481 ' O ' HG13 ' A' ' 91' ' ' ILE . 0.9 OUTLIER -75.29 -35.44 61.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.208 -0.933 . . . . 0.56000000000000005 110.25 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 88' ' ' HIS . . . . . 1.431 ' CG ' ' CE1' ' A' ' 88' ' ' HIS . 22.7 t-80 -68.97 -39.25 79.57 Favored 'General case' 0 C--O 1.187 -2.226 0 O-C-N 120.93 -1.106 . . . . 1.3200000000000001 110.559 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ASP . . . . . 0.981 ' OD1' ' CB ' ' A' ' 89' ' ' ASP . 53.4 m-20 -69.67 -18.87 63.6 Favored 'General case' 0 C--N 1.278 -2.542 0 O-C-N 120.165 -1.585 . . . . 1.3200000000000001 110.908 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.63 -14.78 52.21 Favored Glycine 0 C--O 1.189 -2.681 0 C-N-CA 119.709 -1.234 . . . . 0.63 110.363 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' ILE . . . . . 0.624 HD12 ' HA ' ' A' ' 88' ' ' HIS . 33.9 mt -64.75 -54.33 36.72 Favored Pre-proline 0 C--N 1.286 -2.188 0 O-C-N 120.488 -1.596 . . . . 0.70999999999999996 110.452 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' PRO . . . . . 0.61 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.7 Cg_endo -71.91 -77.32 0.01 OUTLIER 'Trans proline' 0 C--O 1.178 -2.525 0 O-C-N 123.158 1.083 . . . . 0.81000000000000005 110.762 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 93' ' ' VAL . . . . . 0.656 HG12 ' N ' ' A' ' 94' ' ' VAL 0.268 58.9 t -131.26 156.36 42.64 Favored 'Isoleucine or valine' 2 C--O 1.075 -8.098 0 CA-C-O 115.84 -2.029 . . . . 1.6699999999999999 114.69 179.903 . . . . . . . . 4 3 . 1 . 016 nuclear build full ' A' A ' 94' ' ' VAL . . . . . 1.023 ' C ' ' OXT' ' A' ' 97' ' ' SER 0.311 59.8 t -96.38 -44.59 12.87 Favored 'Isoleucine or valine' 3 C--O 0.971 -13.573 0 CA-C-N 121.248 1.84 . . . . 2.4500000000000002 114.471 -179.953 . . . . . . . . 4 3 . 1 . 016 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.756 ' N ' ' OXT' ' A' ' 97' ' ' SER 0.79 48.4 t -100.96 -46.52 5.07 Favored 'General case' 4 C--O 0.734 -26.04 2 CA-C-O 147.325 12.964 . . . . 3.8900000000000001 139.397 -179.958 . . . . . . . . 5 3 . 1 . 016 nuclear build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . 1.005 21.2 t -95.88 -11.97 25.91 Favored 'General case' 4 C--N 0.49 -36.797 3 O-C-N 96.876 -16.14 . . . . 4.2300000000000004 87.062 -179.896 . . . . . . . . 4 2 . 1 . 016 nuclear build full ' A' A ' 97' ' ' SER . . . . . 1.023 ' OXT' ' C ' ' A' ' 94' ' ' VAL 1.351 4.7 m . . . . . 4 C--O 0.283 -49.812 3 CA-C-O 154.849 16.547 . . . . 6.0099999999999998 123.543 179.93 . . . . . . . . 4 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.166 0.507 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -59.16 -35.71 74.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 110.516 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.552 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -56.06 -40.78 74.08 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.096 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.734 ' O ' HD12 ' A' ' 10' ' ' LEU . 4.0 ttp180 -62.29 -32.49 73.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.37 -0.831 . . . . 0.0 109.653 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -77.88 -25.14 48.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.924 179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 t -59.75 -54.19 49.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.935 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.958 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -62.47 -36.92 84.0 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.406 -0.809 . . . . 0.0 109.614 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.734 HD12 ' O ' ' A' ' 6' ' ' ARG . 12.3 mt -67.93 -35.3 78.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 109.54 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -90.79 2.64 55.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.42 -0.8 . . . . 0.0 110.122 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.444 ' CD2' HD21 ' A' ' 87' ' ' LEU . 72.3 t60 -92.59 19.04 7.78 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.302 -0.874 . . . . 0.0 110.224 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -69.21 -44.29 72.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 110.138 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.48 -32.61 74.32 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.395 -0.815 . . . . 0.0 110.169 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.28 -42.31 55.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.326 -0.859 . . . . 0.0 110.169 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HG ' ' HB ' ' A' ' 20' ' ' ILE . 5.2 tt -75.93 -37.42 58.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.426 -0.796 . . . . 0.0 110.244 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -53.53 -41.44 66.38 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.406 -0.809 . . . . 0.0 110.469 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -85.46 -34.32 21.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.512 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.22 -65.53 1.0 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.256 -0.903 . . . . 0.0 110.782 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.477 ' HB ' ' HG ' ' A' ' 16' ' ' LEU . 11.0 mm -108.44 111.13 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.295 -0.878 . . . . 0.0 110.647 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.565 ' O ' ' C ' ' A' ' 22' ' ' THR . 4.3 mtpt -97.06 141.75 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.598 -0.689 . . . . 0.0 109.349 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 21' ' ' LYS . 69.5 p -24.44 97.4 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 CA-C-O 121.455 0.645 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 27.5 t -157.36 -176.8 6.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.556 -0.715 . . . . 0.0 110.154 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 15.9 t80 -33.54 -41.58 0.09 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.773 -0.58 . . . . 0.0 111.788 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.44 HG13 HD12 ' A' ' 20' ' ' ILE . 44.0 mm -59.38 -50.01 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.053 -1.03 . . . . 0.0 110.007 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.571 ' HE1' HD11 ' A' ' 60' ' ' ILE . 0.6 OUTLIER -75.65 -37.49 59.62 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.339 -0.851 . . . . 0.0 110.439 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -72.35 -57.56 4.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.255 -0.903 . . . . 0.0 110.605 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -51.7 -25.22 6.87 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.313 -0.867 . . . . 0.0 110.579 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.6 -57.07 3.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.308 -0.87 . . . . 0.0 110.174 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.669 HG23 ' HB2' ' A' ' 35' ' ' LEU . 83.9 mt -57.12 -47.33 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.271 -0.893 . . . . 0.0 109.937 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 75.0 m -66.27 -15.15 62.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.377 -0.827 . . . . 0.0 110.36 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -59.67 -28.91 67.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.284 -0.885 . . . . 0.0 110.395 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.32 -18.11 1.33 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.186 -1.166 . . . . 0.0 110.186 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -54.5 -60.7 2.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.122 -1.222 . . . . 0.0 110.315 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.669 ' HB2' HG23 ' A' ' 30' ' ' ILE . 1.1 mt -121.66 162.97 19.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.417 -0.802 . . . . 0.0 110.265 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.8 p -60.72 147.73 41.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.343 -0.848 . . . . 0.0 110.401 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 88.8 mt -71.37 -17.84 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.398 -0.814 . . . . 0.0 110.242 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 m -58.82 -27.88 65.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.326 -0.859 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.469 ' O ' HG23 ' A' ' 43' ' ' VAL . 23.0 tt0 -68.43 -26.51 65.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.4 -0.813 . . . . 0.0 110.159 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -63.32 -49.14 75.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.361 -0.837 . . . . 0.0 110.192 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -60.75 -27.97 68.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 110.182 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -77.92 -58.58 3.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 110.064 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.695 HG11 HD13 ' A' ' 56' ' ' LEU . 65.9 t -50.91 -33.4 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.408 -0.808 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.6 ttp85 -50.8 -42.86 58.55 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.256 -0.903 . . . . 0.0 111.34 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -134.27 8.95 3.73 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.029 -1.044 . . . . 0.0 111.455 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.584 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.0 tp10 -73.96 -53.6 3.96 Favored Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.033 -1.042 . . . . 0.0 110.186 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -74.41 170.29 20.57 Favored 'Trans proline' 0 C--N 1.313 -1.325 0 O-C-N 123.388 1.204 . . . . 0.0 110.269 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.3 m -135.84 -38.23 0.72 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.391 -0.818 . . . . 0.0 110.436 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -104.25 -157.46 0.61 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.849 . . . . 0.0 110.262 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -58.09 -19.83 35.1 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.344 -0.847 . . . . 0.0 110.55 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.475 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 7.4 tt0 -52.84 -23.82 7.77 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.238 -0.913 . . . . 0.0 110.56 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG2' HG21 ' A' ' 22' ' ' THR . 21.1 ttp180 -52.98 -53.14 54.31 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.265 -0.897 . . . . 0.0 110.319 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.517 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -80.67 -8.65 59.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.86 . . . . 0.0 110.412 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.475 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -83.85 -36.01 23.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.1 -1.0 . . . . 0.0 110.054 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.4 tpp -81.21 -27.4 35.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.353 -0.842 . . . . 0.0 110.162 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.695 HD13 HG11 ' A' ' 43' ' ' VAL . 14.3 tp -68.87 -38.22 79.57 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.364 -0.835 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.572 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.1 mp -74.15 -45.76 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.317 -0.864 . . . . 0.0 109.825 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -60.64 -38.44 84.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.256 -0.902 . . . . 0.0 109.675 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.4 mmt -56.55 -36.06 68.84 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.386 -0.821 . . . . 0.0 110.113 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.571 HD11 ' HE1' ' A' ' 26' ' ' MET . 79.1 mt -58.02 -52.47 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.322 -0.861 . . . . 0.0 109.916 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.467 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.5 mm? -77.37 -29.43 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.412 -0.805 . . . . 0.0 110.706 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -58.58 -25.89 63.04 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.183 -0.948 . . . . 0.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.8 tptm -83.68 -65.57 0.99 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.908 . . . . 0.0 110.271 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -160.54 170.19 21.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.374 -0.829 . . . . 0.0 110.297 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -84.16 -20.11 32.98 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.421 -0.799 . . . . 0.0 110.271 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -60.41 -43.04 97.11 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.25 -0.906 . . . . 0.0 110.294 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.1 t -61.32 -32.48 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.41 -0.806 . . . . 0.0 110.309 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.958 ' CE1' HD23 ' A' ' 9' ' ' LEU . 6.4 t80 -64.1 -37.18 86.51 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.384 -0.823 . . . . 0.0 110.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.07 -31.82 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.37 -0.831 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.0 t -69.88 -43.57 71.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.294 -0.879 . . . . 0.0 110.019 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.666 ' CE1' HD11 ' A' ' 75' ' ' LEU . 1.1 t80 -53.93 -35.69 61.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.334 -0.854 . . . . 0.0 109.612 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.473 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 25.2 t80 -63.74 -38.5 91.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.499 -0.75 . . . . 0.0 109.858 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -82.96 -25.52 32.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.405 -0.809 . . . . 0.0 110.158 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.43 80.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.666 HD11 ' CE1' ' A' ' 71' ' ' PHE . 45.1 mt -78.36 -40.08 37.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.42 -0.8 . . . . 0.0 110.151 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.43 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.5 mt -65.68 -15.5 62.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.359 -0.838 . . . . 0.0 110.397 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -65.36 -26.32 67.97 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.224 -0.922 . . . . 0.0 110.58 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -108.01 -75.16 0.64 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.922 . . . . 0.0 110.595 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.0 62.93 0.11 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -124.93 16.25 8.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.435 -1.039 . . . . 0.0 110.478 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -46.32 -29.21 1.56 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.376 -0.827 . . . . 0.0 111.031 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.13 -65.05 0.75 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.301 -0.875 . . . . 0.0 110.077 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 87' ' ' LEU . 8.5 tt -66.77 -39.8 87.99 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.45 -39.26 60.86 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.278 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.16 90.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.791 . . . . 0.0 109.902 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 12' ' ' HIS . 8.6 tt -52.52 -46.4 66.67 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.4 -0.812 . . . . 0.0 110.568 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.444 HD21 ' CD2' ' A' ' 12' ' ' HIS . 1.3 mp -73.06 -48.5 35.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.358 -0.839 . . . . 0.0 110.288 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.614 ' HA ' HD12 ' A' ' 91' ' ' ILE . 78.1 t60 -65.37 -16.09 63.25 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.388 -0.82 . . . . 0.0 110.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -85.02 -14.77 46.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.191 -0.943 . . . . 0.0 110.747 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -111.33 -22.86 5.97 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.624 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 54.7 mt -60.59 -52.06 75.39 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.154 -1.204 . . . . 0.0 110.822 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.624 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.6 Cg_endo . . . . . 0 C--N 1.315 -1.23 0 O-C-N 123.221 1.116 . . . . 0.0 110.581 -179.965 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.171 0.51 . . . . 0.0 110.326 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 49.1 tttp -63.35 -32.43 73.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.263 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.32 95.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.382 -0.824 . . . . 0.0 110.071 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.641 ' HG3' HD12 ' A' ' 61' ' ' LEU . 28.5 ttt180 -65.62 -29.66 70.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.367 -0.833 . . . . 0.0 110.126 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.42 ' HA ' HD12 ' A' ' 10' ' ' LEU . 28.1 m120 -74.08 -31.73 62.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.4 -0.813 . . . . 0.0 110.142 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 47.1 t -60.63 -51.9 67.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.4 -0.812 . . . . 0.0 110.294 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.821 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER -61.98 -35.26 77.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.368 -0.832 . . . . 0.0 110.057 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 7' ' ' ASN . 67.4 mt -63.14 -34.36 77.44 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.278 -0.889 . . . . 0.0 109.89 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -97.02 24.98 5.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.391 -0.818 . . . . 0.0 110.066 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.467 ' CE1' HD11 ' A' ' 87' ' ' LEU . 63.6 t60 -94.81 20.02 9.33 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.336 -0.853 . . . . 0.0 110.451 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 70.4 ttp85 -69.29 -56.94 6.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.308 -0.87 . . . . 0.0 110.114 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -65.14 -35.27 80.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.289 -0.882 . . . . 0.0 110.101 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.0 -46.24 65.55 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.371 -0.831 . . . . 0.0 110.298 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.474 HD22 HG13 ' A' ' 57' ' ' ILE . 1.2 tp -59.35 -39.95 84.85 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.38 -41.64 66.09 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.403 -0.811 . . . . 0.0 110.265 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -85.06 -23.22 28.65 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.391 -0.818 . . . . 0.0 110.152 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.99 -65.25 1.03 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.256 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.768 HD13 HG13 ' A' ' 25' ' ' ILE . 14.8 mt -147.24 158.38 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.335 -0.853 . . . . 0.0 110.52 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.577 ' O ' ' C ' ' A' ' 22' ' ' THR . 5.6 mttt -114.34 141.91 47.0 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 21' ' ' LYS . 58.9 p -24.23 98.75 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 CA-C-O 121.516 0.674 . . . . 0.0 110.999 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.8 t -152.06 -176.22 5.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.568 -0.707 . . . . 0.0 110.308 -178.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.9 t80 -32.87 -38.94 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.866 -0.521 . . . . 0.0 112.224 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.768 HG13 HD13 ' A' ' 20' ' ' ILE . 43.9 mm -55.89 -66.31 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 120.954 -1.091 . . . . 0.0 110.175 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.545 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 13.9 mmm -76.53 -35.93 58.0 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.36 -0.837 . . . . 0.0 110.259 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.681 ' HA ' HD12 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -60.14 -52.68 64.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.432 -0.792 . . . . 0.0 110.458 -179.752 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -58.49 -29.7 66.44 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.304 -0.872 . . . . 0.0 110.248 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.5 mtt -69.8 -42.5 73.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.271 -0.893 . . . . 0.0 110.294 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 27' ' ' ASP . 59.2 mt -55.16 -50.24 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.258 -0.901 . . . . 0.0 110.196 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.1 m -74.34 -14.97 60.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.409 -0.807 . . . . 0.0 110.301 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.28 -31.2 65.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.268 -0.895 . . . . 0.0 110.45 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 147.47 -20.03 1.51 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.972 -1.251 . . . . 0.0 109.972 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -57.15 -51.65 68.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.163 -1.198 . . . . 0.0 110.203 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mp -132.12 155.48 48.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.367 -0.833 . . . . 0.0 110.115 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.4 p -57.48 160.22 4.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.414 -0.804 . . . . 0.0 110.324 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.2 mt -71.19 -15.31 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.372 -0.83 . . . . 0.0 110.322 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.3 m -56.18 -26.17 49.64 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.276 -0.89 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -66.55 -34.03 77.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.321 -0.862 . . . . 0.0 110.219 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -68.46 -37.11 79.9 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.315 -0.865 . . . . 0.0 110.174 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.21 -33.82 76.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.428 -0.795 . . . . 0.0 110.1 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -75.99 -60.56 2.27 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.354 -0.841 . . . . 0.0 110.1 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.513 HG21 HD12 ' A' ' 56' ' ' LEU . 80.4 t -48.53 -33.6 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.491 -0.755 . . . . 0.0 110.546 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -43.8 -48.71 8.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.643 -0.661 . . . . 0.0 111.403 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -145.26 14.36 1.45 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.118 -0.989 . . . . 0.0 111.235 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.631 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.1 tp10 -80.17 -47.84 1.33 Allowed Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.032 -1.042 . . . . 0.0 110.962 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -75.99 170.25 20.49 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.154 1.081 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.7 m -145.86 -45.41 0.21 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.362 -0.836 . . . . 0.0 110.289 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -91.51 -166.87 1.66 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.378 -0.826 . . . . 0.0 110.305 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -17.78 45.29 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.359 -0.838 . . . . 0.0 110.498 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -57.04 -18.89 15.88 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.253 -0.905 . . . . 0.0 110.556 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -49.53 -60.86 2.47 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.353 -0.842 . . . . 0.0 110.579 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.536 ' HB2' HG23 ' A' ' 22' ' ' THR . . . -74.14 -52.57 12.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.152 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.97 -34.21 5.35 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.385 -0.822 . . . . 0.0 110.622 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.6 ttp -82.95 -25.56 32.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.513 HD12 HG21 ' A' ' 43' ' ' VAL . 6.6 tt -81.45 -35.69 30.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.345 -0.847 . . . . 0.0 110.342 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.545 ' CD1' ' HE3' ' A' ' 26' ' ' MET . 41.7 mm -64.21 -43.15 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.244 -0.91 . . . . 0.0 109.934 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -61.06 -41.1 95.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.345 -0.847 . . . . 0.0 109.915 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.1 mtp -56.23 -33.33 65.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.303 -0.873 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.471 HD12 ' HA ' ' A' ' 57' ' ' ILE . 91.6 mt -61.19 -53.72 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.241 -0.912 . . . . 0.0 109.985 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.641 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.0 mm? -76.76 -30.22 56.45 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.473 -0.767 . . . . 0.0 110.506 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -26.62 66.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.302 -0.874 . . . . 0.0 110.221 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -64.99 1.03 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.356 -0.84 . . . . 0.0 110.166 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -159.93 155.74 26.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.401 -0.812 . . . . 0.0 110.219 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -77.23 -23.9 51.3 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.357 -0.84 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.08 -29.65 68.72 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.377 -0.827 . . . . 0.0 110.283 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 12.2 t -68.93 -34.91 76.14 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.304 -0.873 . . . . 0.0 110.053 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.821 ' CE1' HD23 ' A' ' 9' ' ' LEU . 19.9 t80 -62.45 -34.6 77.13 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.452 -0.78 . . . . 0.0 110.01 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.89 -40.85 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.41 -0.807 . . . . 0.0 110.033 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -69.42 -34.69 74.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.306 -0.871 . . . . 0.0 110.086 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.598 ' CE1' HD11 ' A' ' 75' ' ' LEU . 32.6 t80 -53.14 -35.48 59.78 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.054 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.882 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 47.6 t80 -70.68 -44.6 66.69 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.333 -0.854 . . . . 0.0 110.198 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -73.26 -27.88 61.82 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.37 -0.831 . . . . 0.0 110.479 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -48.9 65.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.294 -0.879 . . . . 0.0 110.384 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.604 HD13 HD12 ' A' ' 83' ' ' LEU . 14.9 mt -66.46 -44.61 82.31 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.333 -0.855 . . . . 0.0 110.351 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.632 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 35.1 mt -65.32 -15.03 62.11 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 110.544 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -63.33 -24.46 67.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.204 -0.935 . . . . 0.0 110.632 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -112.03 -75.24 0.61 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.206 -0.933 . . . . 0.0 110.543 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -170.8 66.19 0.15 Allowed Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.582 ' CE1' HD11 ' A' ' 20' ' ' ILE . 20.0 m-85 -125.09 16.37 8.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -1.039 . . . . 0.0 110.481 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -43.14 -31.3 0.56 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.914 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.6 -42.08 59.31 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.387 -0.82 . . . . 0.0 109.779 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -73.24 -44.57 59.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.48 -0.763 . . . . 0.0 109.848 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.882 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.34 -33.55 73.81 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.391 -0.818 . . . . 0.0 110.043 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.42 -36.44 82.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 110.113 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.449 HD22 ' HE1' ' A' ' 12' ' ' HIS . 4.8 tt -60.12 -56.96 15.26 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.421 -0.8 . . . . 0.0 110.23 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.467 HD11 ' CE1' ' A' ' 12' ' ' HIS . 1.6 mp -69.24 -35.69 76.39 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.906 . . . . 0.0 110.072 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.698 ' HA ' HD12 ' A' ' 91' ' ' ILE . 49.1 t60 -62.15 -37.57 85.71 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -65.96 -17.56 64.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.426 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -102.57 -2.11 50.1 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.698 HD12 ' HA ' ' A' ' 88' ' ' HIS . 18.5 mt -72.04 -55.48 5.14 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.278 . . . . 0.0 110.34 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.562 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.1 Cg_endo . . . . . 0 C--N 1.313 -1.337 0 O-C-N 123.265 1.139 . . . . 0.0 110.54 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.127 0.489 . . . . 0.0 110.312 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -56.19 -39.5 72.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.32 -0.863 . . . . 0.0 110.458 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.414 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -62.09 -36.98 83.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.287 -0.883 . . . . 0.0 110.188 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.505 ' HG3' HD12 ' A' ' 61' ' ' LEU . 42.6 ttp180 -72.01 -44.09 63.99 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.89 -25.21 67.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.296 -0.877 . . . . 0.0 110.238 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.75 -57.59 10.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.338 -0.851 . . . . 0.0 110.141 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.731 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.8 OUTLIER -56.4 -34.75 67.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.315 -0.866 . . . . 0.0 110.131 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 90.9 mt -80.6 -20.34 43.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.35 -0.844 . . . . 0.0 110.429 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -110.53 31.49 5.92 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -0.856 . . . . 0.0 110.381 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.448 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 4.5 t-160 -142.41 45.0 1.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.351 -0.843 . . . . 0.0 109.987 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -75.09 -37.31 61.59 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.442 -0.786 . . . . 0.0 110.507 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.43 -35.47 65.44 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.175 -0.953 . . . . 0.0 110.595 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.448 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -85.59 -56.3 3.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.288 -0.882 . . . . 0.0 110.312 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.74 HD23 HG13 ' A' ' 57' ' ' ILE . 56.7 tp -55.85 -42.64 76.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.343 -0.848 . . . . 0.0 110.59 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -60.51 -49.29 78.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 0.0 110.079 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -72.19 -26.35 62.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.364 -0.835 . . . . 0.0 110.04 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -72.41 -58.65 3.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.85 . . . . 0.0 110.09 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.723 HD13 HG21 ' A' ' 25' ' ' ILE . 22.8 mt -135.59 109.86 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.366 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.567 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.8 mttt -79.45 142.67 35.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.556 -0.715 . . . . 0.0 109.558 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.567 ' C ' ' O ' ' A' ' 21' ' ' LYS . 61.6 p -23.75 97.34 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 CA-C-O 121.454 0.645 . . . . 0.0 111.09 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 24' ' ' TYR . 32.7 t -152.87 -176.52 5.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.712 -0.617 . . . . 0.0 110.222 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.446 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.7 t80 -33.0 -44.5 0.11 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.826 -0.546 . . . . 0.0 111.957 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.723 HG21 HD13 ' A' ' 20' ' ' ILE . 43.0 mm -54.74 -63.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.075 -1.016 . . . . 0.0 110.195 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.515 ' CE ' HD11 ' A' ' 16' ' ' LEU . 15.1 mtt -75.37 -39.03 59.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -59.79 -51.47 69.59 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.367 -0.833 . . . . 0.0 110.565 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -54.47 -36.1 63.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.268 -0.895 . . . . 0.0 110.337 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -32.19 73.5 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -0.825 . . . . 0.0 110.079 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.634 HD13 HD13 ' A' ' 35' ' ' LEU . 47.2 mm -60.78 -65.13 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.295 -0.878 . . . . 0.0 110.062 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -68.67 -18.62 64.31 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.395 -0.816 . . . . 0.0 110.551 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -24.44 25.89 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.184 -0.947 . . . . 0.0 110.374 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 -13.94 4.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.497 ' CB ' HD12 ' A' ' 35' ' ' LEU . 25.0 m-85 -69.62 -55.24 10.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -1.187 . . . . 0.0 110.454 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.634 HD13 HD13 ' A' ' 30' ' ' ILE . 4.6 mp -121.83 165.17 16.29 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.326 -0.859 . . . . 0.0 110.416 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.0 p -65.16 147.68 53.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 110.24 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.1 mt -73.14 -20.85 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.412 -0.805 . . . . 0.0 110.219 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 m -57.91 -36.79 72.95 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.228 -0.92 . . . . 0.0 110.356 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.453 ' O ' HG23 ' A' ' 43' ' ' VAL . 35.2 tt0 -63.61 -26.84 68.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.368 -0.833 . . . . 0.0 110.212 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -68.69 -45.31 72.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.327 -0.858 . . . . 0.0 110.136 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -63.13 -36.42 83.55 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.316 -0.865 . . . . 0.0 110.152 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -58.24 3.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.423 -0.798 . . . . 0.0 110.179 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 39' ' ' GLU . 68.9 t -50.83 -33.55 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.384 -0.823 . . . . 0.0 110.346 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -46.06 -32.4 2.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.509 -0.744 . . . . 0.0 111.468 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -145.42 21.7 1.51 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.01 -1.057 . . . . 0.0 111.309 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.442 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 0.3 OUTLIER -85.87 -54.53 0.41 Allowed Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.091 -1.006 . . . . 0.0 110.767 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 46' ' ' GLU . 49.9 Cg_endo -77.22 163.87 29.84 Favored 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.456 1.24 . . . . 0.0 110.614 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.9 m -137.4 -42.96 0.55 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.348 -0.845 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.26 -161.25 0.57 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.056 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -15.07 56.17 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.299 -0.875 . . . . 0.0 110.636 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 52.6 tt0 -55.98 -20.16 15.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.193 -0.942 . . . . 0.0 110.664 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.489 ' HG2' HG21 ' A' ' 22' ' ' THR . 25.7 ttm180 -51.45 -54.82 23.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.168 -0.958 . . . . 0.0 110.606 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.36 -29.2 34.15 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.331 -0.856 . . . . 0.0 110.188 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.59 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -62.45 -32.16 72.99 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.257 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 4.9 ttt -80.63 -48.16 13.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.427 -0.795 . . . . 0.0 110.31 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 26' ' ' MET . 23.4 tp -58.68 -36.36 74.07 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.379 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.74 HG13 HD23 ' A' ' 16' ' ' LEU . 0.2 OUTLIER -61.6 -44.47 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.434 -0.791 . . . . 0.0 109.672 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -70.28 -36.77 74.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.47 -0.769 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.404 ' O ' HD21 ' A' ' 35' ' ' LEU . 21.4 mmt -59.52 -36.53 76.3 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.339 -0.851 . . . . 0.0 110.367 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 57' ' ' ILE . 77.0 mt -60.67 -58.56 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.452 -0.78 . . . . 0.0 110.239 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.505 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.43 -40.28 77.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.572 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -59.08 -31.17 68.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.302 -0.874 . . . . 0.0 110.411 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -65.09 0.73 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.319 -0.863 . . . . 0.0 110.183 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -160.16 158.62 30.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.288 -0.882 . . . . 0.0 110.213 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -81.84 -26.86 33.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.456 -0.777 . . . . 0.0 110.194 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.52 -34.25 77.38 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.294 -0.879 . . . . 0.0 110.261 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.3 t -65.15 -36.89 85.65 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.353 -0.842 . . . . 0.0 110.155 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.625 ' HE1' HD23 ' A' ' 9' ' ' LEU . 18.9 t80 -59.25 -36.62 75.82 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.39 -0.819 . . . . 0.0 110.105 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.75 -46.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.361 -0.837 . . . . 0.0 109.986 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.5 t -62.02 -33.97 75.34 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.304 -0.873 . . . . 0.0 109.999 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.796 ' CE1' HD11 ' A' ' 75' ' ' LEU . 3.3 t80 -57.74 -36.67 72.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.35 -0.844 . . . . 0.0 109.787 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 34.6 t80 -62.74 -41.86 99.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.496 -0.752 . . . . 0.0 109.941 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.81 -27.35 40.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.4 -0.813 . . . . 0.0 110.225 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.37 -47.79 84.56 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.325 -0.86 . . . . 0.0 110.192 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.796 HD11 ' CE1' ' A' ' 71' ' ' PHE . 7.8 mt -66.78 -41.17 88.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.328 -0.857 . . . . 0.0 110.224 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.423 HD21 ' HB3' ' A' ' 84' ' ' ALA . 43.6 mt -66.68 -15.11 63.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.421 -0.799 . . . . 0.0 110.57 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -61.96 -22.41 65.62 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.191 -0.943 . . . . 0.0 110.549 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -112.53 -75.15 0.61 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.22 -0.925 . . . . 0.0 110.426 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.97 36.9 0.11 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -93.78 16.44 14.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.458 -1.025 . . . . 0.0 110.49 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -42.19 -31.33 0.37 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.522 -0.736 . . . . 0.0 110.906 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -67.52 -48.1 68.01 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.356 -0.84 . . . . 0.0 109.703 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.659 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -78.09 -44.02 27.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.508 -0.745 . . . . 0.0 109.827 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.423 ' HB3' HD21 ' A' ' 76' ' ' LEU . . . -59.15 -43.47 92.06 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.349 -0.844 . . . . 0.0 110.238 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.03 -29.72 70.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.35 -0.844 . . . . 0.0 110.11 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.7 tp -57.43 -46.09 83.93 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.355 -0.841 . . . . 0.0 110.309 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mp -73.97 -33.42 63.86 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.856 ' HA ' HD12 ' A' ' 91' ' ' ILE . 13.3 t-160 -58.91 -25.77 63.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.348 -0.845 . . . . 0.0 110.386 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -85.04 -18.85 33.09 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.335 -0.853 . . . . 0.0 110.451 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -97.08 -26.98 9.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.856 HD12 ' HA ' ' A' ' 88' ' ' HIS . 42.9 mt -56.87 -47.88 98.3 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.352 -1.087 . . . . 0.0 110.977 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo . . . . . 0 C--N 1.315 -1.225 0 O-C-N 123.223 1.117 . . . . 0.0 110.72 -179.721 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.112 0.482 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -29.35 61.14 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.329 -0.857 . . . . 0.0 110.575 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.69 -38.04 88.84 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.235 -0.915 . . . . 0.0 110.223 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -68.1 -28.51 67.4 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.206 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -79.44 -27.21 41.68 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.351 -0.843 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.62 -51.0 70.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.474 -0.766 . . . . 0.0 110.165 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.731 ' O ' HD13 ' A' ' 9' ' ' LEU . 3.0 tm? -62.53 -36.77 83.64 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.369 -0.832 . . . . 0.0 109.752 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.47 -27.53 62.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.319 -0.863 . . . . 0.0 110.137 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -98.07 27.47 4.55 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.285 -0.884 . . . . 0.0 110.121 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.917 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 3.5 t-160 -124.22 26.92 7.27 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.468 -0.77 . . . . 0.0 109.9 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -75.68 -36.58 60.03 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.286 -0.884 . . . . 0.0 110.475 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -68.36 -36.0 78.55 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.295 -0.878 . . . . 0.0 110.617 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.917 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -85.05 -30.28 24.24 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.361 -0.837 . . . . 0.0 110.027 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.405 ' CD2' ' CG1' ' A' ' 57' ' ' ILE . 1.3 tp -80.72 -44.03 19.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.395 -0.815 . . . . 0.0 110.032 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -59.16 -35.66 73.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.385 -0.822 . . . . 0.0 110.071 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -78.2 -41.78 33.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.38 -0.825 . . . . 0.0 110.285 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.24 -65.28 1.03 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.241 -0.912 . . . . 0.0 110.514 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.645 HD12 HG21 ' A' ' 25' ' ' ILE . 12.8 mm -94.95 109.69 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.544 ' O ' ' C ' ' A' ' 22' ' ' THR . 2.7 mtpm? -103.28 141.3 36.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.59 -0.694 . . . . 0.0 109.284 179.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.692 HG21 ' HD3' ' A' ' 52' ' ' ARG . 73.4 p -24.68 98.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.677 -0.64 . . . . 0.0 110.987 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.438 ' O ' ' C ' ' A' ' 24' ' ' TYR . 81.4 p -159.97 -176.58 5.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.559 -0.713 . . . . 0.0 110.377 -178.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.438 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.7 t80 -33.55 -39.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.86 -0.525 . . . . 0.0 111.939 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.645 HG21 HD12 ' A' ' 20' ' ' ILE . 44.8 mm -57.23 -65.69 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.029 -1.044 . . . . 0.0 109.997 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.437 ' SD ' HD11 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -76.11 -40.87 51.94 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 110.189 179.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -55.02 -60.02 3.95 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.363 -0.835 . . . . 0.0 110.717 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -56.73 -38.82 72.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.35 -0.844 . . . . 0.0 110.457 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.557 ' HE3' HG23 ' A' ' 60' ' ' ILE . 4.5 ttp -62.99 -28.11 69.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.377 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.557 HG23 ' HB2' ' A' ' 35' ' ' LEU . 27.2 mt -83.85 -34.55 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.259 -0.9 . . . . 0.0 110.29 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -87.26 -18.73 29.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.294 -0.879 . . . . 0.0 110.512 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -57.58 -23.7 52.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.238 -0.914 . . . . 0.0 110.38 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 141.23 -17.13 2.72 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.821 -1.311 . . . . 0.0 109.821 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.64 ' C ' HD22 ' A' ' 35' ' ' LEU . 7.1 m-30 -53.84 -66.6 0.36 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.237 -1.154 . . . . 0.0 110.333 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.64 HD22 ' C ' ' A' ' 34' ' ' PHE . 4.0 mm? -106.44 165.15 11.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.488 -0.757 . . . . 0.0 110.058 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.3 p -59.59 169.34 1.34 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.432 -0.792 . . . . 0.0 110.273 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.8 mt -84.68 -24.45 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.384 -0.823 . . . . 0.0 110.158 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.4 m -58.91 -24.53 62.47 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.348 -0.845 . . . . 0.0 110.365 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -60.67 -35.88 77.35 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.31 -0.869 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.45 -36.34 80.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.75 -27.04 63.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.341 -0.849 . . . . 0.0 110.096 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 ttmt -82.95 -61.75 1.78 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.378 -0.826 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 61.7 t -48.05 -33.75 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.585 -0.697 . . . . 0.0 110.838 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttm-85 -45.98 -47.22 16.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.486 -0.759 . . . . 0.0 111.279 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -144.99 23.82 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.147 -0.971 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.611 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 1.1 tm-20 -81.82 -48.91 0.95 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.863 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.2 Cg_endo -75.99 169.88 21.23 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.127 1.067 . . . . 0.0 110.526 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.4 m -136.69 -41.97 0.61 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.404 -0.81 . . . . 0.0 110.139 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -100.2 -152.88 0.43 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.009 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.21 -7.65 48.23 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.222 -0.924 . . . . 0.0 110.66 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -55.72 -21.28 17.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.108 -0.995 . . . . 0.0 110.663 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.692 ' HD3' HG21 ' A' ' 22' ' ' THR . 20.3 ttm180 -52.76 -32.46 43.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.25 -0.906 . . . . 0.0 110.557 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.491 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -91.57 -11.67 36.6 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.299 -0.876 . . . . 0.0 110.524 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.65 -42.76 14.02 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.077 -1.014 . . . . 0.0 110.244 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -43.02 24.17 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.312 -0.867 . . . . 0.0 110.219 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.506 HD22 HG22 ' A' ' 22' ' ' THR . 18.2 tp -60.15 -38.73 84.02 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.245 -0.91 . . . . 0.0 110.125 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.573 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.2 mp -76.51 -34.33 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.368 -0.833 . . . . 0.0 109.684 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -68.06 -38.11 82.06 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.323 -0.861 . . . . 0.0 109.641 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 mtt -59.88 -35.02 73.95 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.029 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.557 HG23 ' HE3' ' A' ' 29' ' ' MET . 95.8 mt -58.27 -52.33 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.396 -0.815 . . . . 0.0 110.036 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -75.18 -22.19 58.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.39 -0.819 . . . . 0.0 110.763 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.51 -27.36 63.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.252 -0.905 . . . . 0.0 110.585 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HB2' HD11 ' A' ' 35' ' ' LEU . 47.5 tptt -70.8 -65.17 0.77 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.263 -0.898 . . . . 0.0 110.208 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -160.11 155.51 25.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.404 -0.81 . . . . 0.0 110.275 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.8 -28.19 65.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.464 -0.773 . . . . 0.0 110.125 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -62.41 -37.1 84.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.465 -0.772 . . . . 0.0 110.213 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.1 t -60.93 -33.22 72.82 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.294 -0.879 . . . . 0.0 110.174 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.64 ' HE1' HD23 ' A' ' 9' ' ' LEU . 15.6 t80 -64.86 -39.93 94.34 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.464 -0.772 . . . . 0.0 110.118 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.45 -31.79 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.335 -0.853 . . . . 0.0 110.074 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.6 t -70.61 -38.93 74.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.353 -0.842 . . . . 0.0 109.984 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.575 ' CE2' HD22 ' A' ' 87' ' ' LEU . 5.0 t80 -54.82 -38.19 67.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.385 -0.822 . . . . 0.0 109.818 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.703 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.0 t80 -65.08 -46.87 79.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.377 -0.827 . . . . 0.0 109.941 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.446 ' HA ' HD12 ' A' ' 76' ' ' LEU . 4.0 t30 -72.02 -25.95 62.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.369 -0.832 . . . . 0.0 110.42 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.32 -45.03 74.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 110.178 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.544 HD11 ' CE1' ' A' ' 71' ' ' PHE . 28.5 mt -68.56 -38.17 80.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.325 -0.859 . . . . 0.0 110.353 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.703 HD11 ' CE1' ' A' ' 72' ' ' TYR . 22.6 mt -66.38 -15.17 63.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.349 -0.844 . . . . 0.0 110.576 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -63.04 -22.81 67.11 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.214 -0.929 . . . . 0.0 110.549 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.49 -75.46 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.212 -0.93 . . . . 0.0 110.407 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.2 35.94 0.1 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -95.28 16.2 17.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.995 . . . . 0.0 110.449 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 11.9 ttpt -46.48 -30.58 2.26 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.392 -0.817 . . . . 0.0 110.973 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -62.09 -60.92 2.9 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.285 -0.884 . . . . 0.0 109.821 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 83' ' ' LEU . 5.5 tt -71.28 -43.8 66.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.442 -0.786 . . . . 0.0 109.992 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.27 -40.53 71.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.444 -0.785 . . . . 0.0 110.305 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.57 -35.17 75.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.636 HD23 ' CE1' ' A' ' 12' ' ' HIS . 19.3 tp -61.69 -28.24 69.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.369 -0.832 . . . . 0.0 110.271 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 71' ' ' PHE . 0.6 OUTLIER -84.62 -39.52 18.58 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.31 -0.869 . . . . 0.0 110.429 -179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.846 ' HA ' HD12 ' A' ' 91' ' ' ILE . 48.5 t-80 -67.36 -47.8 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -69.59 -15.07 63.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.349 -0.844 . . . . 0.0 110.562 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -91.37 -16.38 53.23 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 88' ' ' HIS . 18.7 mt -66.54 -53.77 27.56 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.159 -1.201 . . . . 0.0 110.436 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.576 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo . . . . . 0 C--N 1.313 -1.331 0 O-C-N 123.336 1.177 . . . . 0.0 110.706 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.742 0 CA-C-O 121.155 0.502 . . . . 0.0 110.272 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -58.17 -50.46 73.46 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.317 -0.865 . . . . 0.0 110.269 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.708 ' CB ' HG23 ' A' ' 91' ' ' ILE . . . -61.21 -35.65 77.77 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.286 -0.884 . . . . 0.0 109.786 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HG3' HD12 ' A' ' 61' ' ' LEU . 23.0 ttm-85 -68.42 -36.01 78.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.393 -0.817 . . . . 0.0 109.79 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -65.5 -32.86 74.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.473 -0.767 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.4 t -57.57 -59.83 4.58 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.312 -0.868 . . . . 0.0 110.082 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.938 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.4 tm? -59.33 -34.85 72.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.349 -0.844 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.5 mt -73.62 -28.0 61.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.367 -0.833 . . . . 0.0 110.054 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -93.66 1.98 56.45 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.42 -0.8 . . . . 0.0 110.567 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.635 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 4.3 t60 -98.15 28.99 3.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.155 -0.966 . . . . 0.0 109.696 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -71.01 -55.25 8.68 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.304 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.41 -34.58 75.6 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.635 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -74.2 -34.72 63.81 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.293 -0.879 . . . . 0.0 110.133 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.66 HD13 HG13 ' A' ' 57' ' ' ILE . 8.3 tt -77.16 -40.81 44.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.464 -0.773 . . . . 0.0 110.39 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.8 -41.88 62.04 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.28 -0.888 . . . . 0.0 110.405 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.6 ttpt -85.5 -32.0 22.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.343 -0.848 . . . . 0.0 110.548 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.627 ' HB3' HD11 ' A' ' 83' ' ' LEU . 70.6 m-20 -85.18 -65.53 1.0 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.879 . . . . 0.0 111.01 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 25' ' ' ILE . 13.4 mm -114.58 122.33 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.23 -0.919 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.553 ' O ' ' C ' ' A' ' 22' ' ' THR . 19.2 mtmm -113.75 141.89 46.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.631 -0.668 . . . . 0.0 109.23 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.809 HG22 HD22 ' A' ' 56' ' ' LEU . 74.0 p -24.1 97.53 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.652 -0.655 . . . . 0.0 111.149 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 24' ' ' TYR . 34.9 t -160.63 -176.75 5.74 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.487 -0.758 . . . . 0.0 110.557 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 23' ' ' SER . 8.1 t80 -33.57 -46.67 0.2 Allowed 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.899 -0.501 . . . . 0.0 112.168 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.473 HG21 HD12 ' A' ' 20' ' ' ILE . 38.6 mm -49.91 -64.67 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.06 -1.025 . . . . 0.0 110.527 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.586 ' HE2' HD11 ' A' ' 16' ' ' LEU . 4.5 mmt -72.75 -53.5 11.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.345 -0.847 . . . . 0.0 110.367 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -46.64 -43.92 17.93 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.51 -0.744 . . . . 0.0 111.067 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 58.0 t60 -59.64 -37.35 78.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.119 -0.988 . . . . 0.0 109.846 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 29.9 mmt -80.26 -28.23 38.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.419 -0.801 . . . . 0.0 110.199 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.711 HG21 ' OE1' ' A' ' 40' ' ' GLU . 29.4 mm -64.41 -50.45 76.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.351 -0.843 . . . . 0.0 109.937 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.0 m -75.71 -19.74 58.87 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.348 -0.845 . . . . 0.0 110.483 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -24.07 47.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.164 -0.96 . . . . 0.0 110.358 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.47 -17.52 2.06 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.637 ' C ' HD22 ' A' ' 35' ' ' LEU . 12.6 m-30 -56.23 -72.33 0.08 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.217 -1.166 . . . . 0.0 110.451 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.637 HD22 ' C ' ' A' ' 34' ' ' PHE . 4.0 mm? -106.47 161.82 14.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.293 -0.879 . . . . 0.0 110.227 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 p -70.67 162.5 28.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.403 -0.811 . . . . 0.0 110.095 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.0 mt -79.25 -29.13 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.287 -0.883 . . . . 0.0 110.06 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -61.97 -33.16 73.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.405 -0.809 . . . . 0.0 110.171 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.711 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.5 tt0 -75.02 -26.74 59.71 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 110.316 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.711 ' OE1' HG21 ' A' ' 30' ' ' ILE . 9.1 tp10 -74.0 -39.02 63.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.288 -0.882 . . . . 0.0 110.313 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -62.13 -35.93 80.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.296 -0.878 . . . . 0.0 110.261 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.401 ' O ' ' N ' ' A' ' 46' ' ' GLU . 16.0 tttt -72.29 -41.89 66.14 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.201 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.711 HG23 ' O ' ' A' ' 39' ' ' GLU . 98.9 t -58.26 -34.47 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.344 -0.848 . . . . 0.0 110.38 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -55.87 -24.78 38.98 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.333 -0.854 . . . . 0.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -142.69 15.4 1.96 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.128 -0.982 . . . . 0.0 111.073 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.629 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 34.1 tt0 -81.85 -51.19 0.83 Allowed Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.017 -1.052 . . . . 0.0 110.585 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.629 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -76.61 170.2 20.37 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.201 1.106 . . . . 0.0 110.404 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.3 m -124.71 -39.04 2.32 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.36 -0.837 . . . . 0.0 110.274 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -104.31 -153.48 0.48 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.307 -0.871 . . . . 0.0 110.053 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -8.73 51.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.211 -0.931 . . . . 0.0 110.656 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -52.06 -24.97 7.56 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.114 -0.991 . . . . 0.0 110.65 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HG2' HG21 ' A' ' 22' ' ' THR . 24.2 ttp180 -52.95 -25.26 11.37 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.246 -0.909 . . . . 0.0 110.544 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.445 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -86.96 -26.32 23.89 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.309 -0.87 . . . . 0.0 110.315 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.82 -29.41 50.64 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 110.373 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.3 ttt -79.16 -52.47 8.13 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.304 -0.872 . . . . 0.0 110.481 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.809 HD22 HG22 ' A' ' 22' ' ' THR . 32.1 tp -51.08 -35.06 33.03 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.375 -0.828 . . . . 0.0 110.95 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.705 ' HA ' HD12 ' A' ' 60' ' ' ILE . 0.8 OUTLIER -72.78 -32.19 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.219 -0.926 . . . . 0.0 110.265 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -70.87 -35.63 72.47 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 110.348 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.467 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -65.04 -29.49 70.39 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.229 -0.919 . . . . 0.0 110.141 179.672 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.705 HD12 ' HA ' ' A' ' 57' ' ' ILE . 96.6 mt -62.74 -53.55 45.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.886 . . . . 0.0 109.684 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.571 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.1 mm? -73.67 -37.22 65.34 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt -60.34 -27.55 67.45 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.336 -0.853 . . . . 0.0 110.524 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -78.67 -64.66 1.12 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.154 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -160.2 153.89 22.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.351 -0.843 . . . . 0.0 110.207 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -74.96 -24.13 58.41 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.32 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -36.82 83.0 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.313 -0.867 . . . . 0.0 110.114 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.8 t -61.66 -31.47 71.59 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.468 -0.77 . . . . 0.0 110.061 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.938 ' CE1' HD23 ' A' ' 9' ' ' LEU . 8.7 t80 -68.2 -38.53 82.06 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.323 -0.861 . . . . 0.0 110.008 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.7 -42.54 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.345 -0.847 . . . . 0.0 110.105 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.8 t -62.96 -39.13 93.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.88 . . . . 0.0 109.938 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.72 ' CE2' HD11 ' A' ' 75' ' ' LEU . 1.8 t80 -53.25 -36.62 61.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.469 -0.77 . . . . 0.0 109.824 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.687 ' CE1' HD11 ' A' ' 76' ' ' LEU . 31.3 t80 -63.53 -45.91 88.39 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.308 -0.87 . . . . 0.0 110.075 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 0.459 ' HA ' HD12 ' A' ' 76' ' ' LEU . 5.5 t30 -75.98 -23.07 55.28 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.308 -0.87 . . . . 0.0 110.583 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.11 -33.99 75.53 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.176 -0.952 . . . . 0.0 110.403 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.72 HD11 ' CE2' ' A' ' 71' ' ' PHE . 4.3 mt -84.79 -33.69 22.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.34 -0.85 . . . . 0.0 110.432 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.708 HD21 ' CB ' ' A' ' 84' ' ' ALA . 26.6 mt -67.65 -14.93 63.37 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.375 -0.828 . . . . 0.0 110.584 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -66.51 -24.45 66.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.158 -0.964 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -103.26 -75.1 0.62 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.219 -0.926 . . . . 0.0 110.504 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.85 48.3 0.15 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -106.27 16.16 25.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.435 -1.038 . . . . 0.0 110.495 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -46.14 -32.74 3.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.387 -0.82 . . . . 0.0 110.735 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -68.63 -63.59 1.03 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 109.856 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.724 HD23 ' O ' ' A' ' 83' ' ' LEU . 4.7 tt -62.79 -36.43 83.11 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.89 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.708 ' CB ' HD21 ' A' ' 76' ' ' LEU . . . -59.95 -36.69 77.62 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.469 -0.769 . . . . 0.0 110.044 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.23 -34.27 74.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.455 -0.778 . . . . 0.0 110.07 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.89 -47.48 84.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.451 -0.781 . . . . 0.0 109.926 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.41 ' O ' HD12 ' A' ' 91' ' ' ILE . 0.9 OUTLIER -72.1 -39.96 68.53 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.36 -0.838 . . . . 0.0 110.174 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.653 ' HA ' HD12 ' A' ' 91' ' ' ILE . 27.5 t-80 -62.42 -55.54 26.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.38 -0.825 . . . . 0.0 110.173 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.5 -24.78 61.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.806 . . . . 0.0 110.302 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -75.04 -14.44 81.81 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.708 HG23 ' CB ' ' A' ' 5' ' ' ALA . 7.9 mt -72.84 -57.64 3.02 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.211 -1.17 . . . . 0.0 110.328 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.591 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 47.1 Cg_endo . . . . . 0 C--N 1.314 -1.274 0 O-C-N 123.29 1.153 . . . . 0.0 110.467 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.716 0 CA-C-O 121.127 0.489 . . . . 0.0 110.227 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -59.44 -37.44 78.12 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.399 -0.813 . . . . 0.0 110.212 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.21 -38.21 79.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.276 -0.89 . . . . 0.0 109.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.658 ' HG3' HD12 ' A' ' 61' ' ' LEU . 47.2 ttt180 -64.64 -31.93 73.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.381 -0.824 . . . . 0.0 109.778 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -75.68 -27.79 58.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.431 -0.793 . . . . 0.0 110.028 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.9 t -61.83 -60.44 3.64 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.319 -0.863 . . . . 0.0 110.168 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.748 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.8 OUTLIER -53.33 -34.89 59.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.359 -0.838 . . . . 0.0 110.105 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 48.9 mt -79.97 -26.22 40.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.355 -0.84 . . . . 0.0 110.273 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -110.15 33.25 4.56 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.407 -0.808 . . . . 0.0 110.337 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.439 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.6 t-160 -146.39 43.54 1.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.331 -0.855 . . . . 0.0 110.081 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.3 ttp85 -75.36 -31.5 60.55 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.443 -0.786 . . . . 0.0 110.297 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.07 -34.43 70.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.225 -0.922 . . . . 0.0 110.402 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.439 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -84.93 -42.43 14.98 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.094 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.703 HD22 HG12 ' A' ' 57' ' ' ILE . 9.2 tt -63.1 -37.37 86.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.385 -0.822 . . . . 0.0 110.19 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -76.09 -32.07 59.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.79 . . . . 0.0 110.073 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -64.78 -49.66 69.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.43 -0.794 . . . . 0.0 110.128 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -84.55 -55.72 3.98 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.381 -0.825 . . . . 0.0 110.066 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.655 HG21 ' CE ' ' A' ' 26' ' ' MET . 14.9 mm -98.95 158.19 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.292 -0.88 . . . . 0.0 109.995 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.561 ' O ' ' C ' ' A' ' 22' ' ' THR . 50.9 mttt -154.14 141.52 19.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.477 -0.765 . . . . 0.0 109.481 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.931 HG22 HD22 ' A' ' 56' ' ' LEU . 67.9 p -24.63 96.5 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 121.47 0.652 . . . . 0.0 110.893 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 42.7 m -163.36 -175.84 4.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.548 -0.72 . . . . 0.0 110.157 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 11.2 t80 -33.08 -37.26 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.894 -0.504 . . . . 0.0 112.092 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.607 HG13 HD12 ' A' ' 20' ' ' ILE . 46.2 mm -54.63 -65.78 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.047 -1.033 . . . . 0.0 109.994 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.655 ' CE ' HG21 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -76.43 -34.47 58.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.349 -0.844 . . . . 0.0 110.374 179.544 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -57.32 -41.88 80.8 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.364 -0.835 . . . . 0.0 110.553 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -75.01 -50.37 16.76 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.308 -0.87 . . . . 0.0 110.37 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 mpp? -60.02 -50.33 74.14 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.338 -0.851 . . . . 0.0 110.437 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.908 HG23 ' HB2' ' A' ' 35' ' ' LEU . 98.6 mt -61.35 -28.66 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.459 -0.776 . . . . 0.0 110.297 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.0 m -90.32 -23.0 21.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.353 -0.842 . . . . 0.0 110.354 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -59.72 -21.48 60.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.332 -0.855 . . . . 0.0 110.421 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.24 -16.59 2.1 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.656 ' C ' HD22 ' A' ' 35' ' ' LEU . 7.4 m-30 -53.15 -71.56 0.07 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.147 -1.208 . . . . 0.0 110.247 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.908 ' HB2' HG23 ' A' ' 30' ' ' ILE . 4.0 mm? -108.12 164.12 12.57 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 109.908 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 p -62.53 144.33 56.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.376 -0.827 . . . . 0.0 110.197 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.554 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.5 mp -69.53 -22.97 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.24 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -57.02 -27.88 62.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.297 -0.877 . . . . 0.0 110.316 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -62.34 -37.46 85.72 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.38 -0.825 . . . . 0.0 110.077 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.55 -33.11 72.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.412 -0.805 . . . . 0.0 110.201 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -69.0 -31.13 69.73 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.316 -0.865 . . . . 0.0 110.229 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HG2' ' CB ' ' A' ' 46' ' ' GLU . 1.6 ttmt -84.87 -59.47 2.34 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 110.377 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.442 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 88.7 t -48.5 -33.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.501 -0.749 . . . . 0.0 110.786 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -44.97 -45.43 10.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.554 -0.716 . . . . 0.0 111.421 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -144.49 15.2 1.62 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.092 -1.005 . . . . 0.0 111.125 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.623 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 3.0 tm-20 -79.94 -48.09 1.38 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.116 -0.99 . . . . 0.0 110.891 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.623 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -75.49 166.78 27.94 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.121 1.063 . . . . 0.0 110.522 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.3 m -136.44 -42.93 0.62 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.438 -0.789 . . . . 0.0 110.174 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -96.2 -159.23 0.71 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.35 -0.844 . . . . 0.0 110.129 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -64.06 -14.58 55.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.313 -0.867 . . . . 0.0 110.641 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -55.96 -19.96 14.39 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.271 -0.893 . . . . 0.0 110.721 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -49.69 -49.68 46.7 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.342 -0.849 . . . . 0.0 110.496 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.27 -42.98 53.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.396 -0.815 . . . . 0.0 110.323 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.43 -34.06 4.41 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.254 -0.904 . . . . 0.0 110.801 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 19.0 ttt -85.03 -24.75 28.05 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.306 -0.872 . . . . 0.0 110.019 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.931 HD22 HG22 ' A' ' 22' ' ' THR . 4.8 tp -82.01 -46.85 13.39 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.374 -0.828 . . . . 0.0 110.72 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.703 HG12 HD22 ' A' ' 16' ' ' LEU . 1.9 mp -68.63 -32.4 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.272 -0.893 . . . . 0.0 110.242 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp -71.04 -39.45 72.29 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.238 -0.914 . . . . 0.0 110.062 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.0 mmt -58.89 -29.24 66.87 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.355 -0.84 . . . . 0.0 110.338 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 57' ' ' ILE . 92.9 mt -67.08 -59.9 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.368 -0.833 . . . . 0.0 110.078 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.658 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.25 -38.75 78.61 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.447 -0.783 . . . . 0.0 110.483 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -59.87 -25.37 65.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.323 -0.861 . . . . 0.0 110.387 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.57 ' HB2' HD11 ' A' ' 35' ' ' LEU . 5.9 tptp -73.54 -65.43 0.82 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.44 169.95 21.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 110.376 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -83.9 -26.09 29.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.769 . . . . 0.0 110.14 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.01 -40.78 98.8 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.369 -0.832 . . . . 0.0 110.008 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.4 t -60.06 -33.28 71.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.29 -0.881 . . . . 0.0 110.12 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.618 ' HE1' HD23 ' A' ' 9' ' ' LEU . 26.7 t80 -65.73 -40.96 92.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.39 -0.819 . . . . 0.0 109.892 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.2 -41.38 83.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.387 -0.821 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.2 t -64.11 -32.7 74.36 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.351 -0.843 . . . . 0.0 110.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.645 ' CE1' HD11 ' A' ' 75' ' ' LEU . 7.8 t80 -57.97 -42.19 84.52 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.4 -0.813 . . . . 0.0 109.89 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.827 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 36.3 t80 -62.6 -37.95 88.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.389 -0.82 . . . . 0.0 110.251 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -76.96 -32.93 57.63 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.463 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.58 -30.48 71.35 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 110.247 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.649 HD23 ' CD2' ' A' ' 80' ' ' TYR . 6.4 mt -84.98 -39.63 17.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.404 -0.81 . . . . 0.0 110.339 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.827 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 24.1 mt -68.85 -15.51 63.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.343 -0.848 . . . . 0.0 110.601 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.9 -21.1 64.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.267 -0.896 . . . . 0.0 110.622 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -109.66 -75.34 0.63 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.176 -0.952 . . . . 0.0 110.499 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.15 35.5 0.1 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.649 ' CD2' HD23 ' A' ' 75' ' ' LEU . 17.5 m-85 -98.35 16.43 21.59 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.378 -1.072 . . . . 0.0 110.438 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 11.1 tttm -44.98 -29.79 0.9 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -0.784 . . . . 0.0 110.831 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -73.64 -45.16 54.45 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 109.794 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.0 tm? -78.88 -40.19 33.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.505 -0.747 . . . . 0.0 109.861 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.24 -31.23 72.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.379 -0.826 . . . . 0.0 110.097 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -68.8 -34.87 76.24 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.45 -0.781 . . . . 0.0 110.21 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.9 tp -60.0 -45.76 91.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.382 -0.824 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.441 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.2 mt -77.38 -24.59 50.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.349 -0.844 . . . . 0.0 110.441 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.518 ' HA ' HD12 ' A' ' 91' ' ' ILE . 33.2 t-80 -79.11 -42.51 26.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.264 -0.897 . . . . 0.0 110.488 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -60.76 -19.92 60.23 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.309 -0.87 . . . . 0.0 110.494 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -86.63 -19.26 56.94 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.61 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 78.7 mt -61.95 -51.14 77.43 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.187 -1.184 . . . . 0.0 110.728 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.61 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.6 Cg_endo . . . . . 0 C--N 1.315 -1.211 0 O-C-N 123.116 1.061 . . . . 0.0 110.635 -179.975 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.715 0 CA-C-O 121.135 0.493 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -60.25 -31.62 70.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.253 -0.904 . . . . 0.0 110.391 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.551 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -72.73 -39.3 67.0 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.351 -0.843 . . . . 0.0 110.07 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.714 ' HG3' HD12 ' A' ' 61' ' ' LEU . 11.7 ttt-85 -69.08 -26.28 64.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.514 -0.741 . . . . 0.0 110.187 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -76.08 -31.5 58.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.5 t -60.79 -56.3 22.81 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.371 -0.83 . . . . 0.0 110.173 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.71 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -55.31 -38.76 69.1 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.349 -0.844 . . . . 0.0 110.176 179.897 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.404 HD11 ' CZ ' ' A' ' 6' ' ' ARG . 84.8 mt -63.12 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.374 -0.829 . . . . 0.0 110.178 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -108.21 7.64 27.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.36 -0.837 . . . . 0.0 110.59 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.476 ' CE1' ' HG ' ' A' ' 86' ' ' LEU . 23.3 t-160 -103.86 32.35 3.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.171 -0.956 . . . . 0.0 109.92 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -75.06 -24.81 58.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.473 -0.767 . . . . 0.0 110.465 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -53.63 -35.74 61.28 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.194 -0.942 . . . . 0.0 110.379 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.83 -51.59 6.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.404 -0.81 . . . . 0.0 110.038 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.504 HD12 ' HB ' ' A' ' 20' ' ' ILE . 64.4 tp -57.44 -30.05 64.69 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 110.255 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -85.4 -33.16 22.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.435 -0.791 . . . . 0.0 110.371 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -67.5 -57.08 7.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.361 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -81.76 -65.2 1.04 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 110.391 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.504 ' HB ' HD12 ' A' ' 16' ' ' LEU . 14.8 mm -79.27 162.4 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.287 -0.883 . . . . 0.0 110.18 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.571 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.9 mttt -156.28 141.2 17.18 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.603 HG21 ' HG2' ' A' ' 52' ' ' ARG . 62.8 p -24.97 96.2 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.692 -0.63 . . . . 0.0 110.849 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.433 ' N ' ' O ' ' A' ' 21' ' ' LYS . 23.1 m -163.19 -175.96 4.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.617 -0.677 . . . . 0.0 110.304 -178.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.431 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.0 t80 -32.79 -40.56 0.05 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.831 -0.543 . . . . 0.0 112.176 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.637 ' CG2' HD21 ' A' ' 75' ' ' LEU . 41.5 mm -57.3 -65.71 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 120.918 -1.114 . . . . 0.0 110.029 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.461 ' HE3' HD23 ' A' ' 56' ' ' LEU . 10.5 mtm -75.86 -37.4 58.99 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.385 -0.822 . . . . 0.0 110.073 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 0.616 ' HA ' HD12 ' A' ' 30' ' ' ILE . 4.5 t70 -57.88 -50.54 73.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.428 -0.795 . . . . 0.0 110.358 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -55.59 -37.87 68.67 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.317 -0.864 . . . . 0.0 110.101 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.7 mtp -63.23 -38.43 91.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.409 -0.807 . . . . 0.0 110.131 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 27' ' ' ASP . 93.7 mt -61.87 -36.61 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.029 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.4 m -92.83 -19.78 21.37 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.301 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -56.22 -24.78 44.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.312 -0.868 . . . . 0.0 110.301 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.22 -12.34 3.82 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.674 ' C ' HD22 ' A' ' 35' ' ' LEU . 24.0 m-85 -67.53 -58.29 4.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.12 -1.224 . . . . 0.0 110.297 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.674 HD22 ' C ' ' A' ' 34' ' ' PHE . 3.9 mm? -109.58 165.14 11.89 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.326 -0.859 . . . . 0.0 110.225 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 42.8 p -65.14 163.56 14.77 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.079 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.1 mt -84.83 -27.87 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.284 -0.885 . . . . 0.0 110.177 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.5 m -62.35 -25.45 67.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.357 -0.839 . . . . 0.0 110.261 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.49 -29.31 65.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.833 . . . . 0.0 110.243 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.31 -53.89 52.19 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.326 -0.859 . . . . 0.0 110.25 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -59.63 -25.55 64.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.316 -0.865 . . . . 0.0 110.199 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.409 ' CG ' ' HG3' ' A' ' 46' ' ' GLU . 30.0 ttmt -76.46 -64.54 1.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.331 -0.856 . . . . 0.0 110.159 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.48 HG11 HD13 ' A' ' 56' ' ' LEU . 59.1 t -49.88 -33.65 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.493 -0.754 . . . . 0.0 110.699 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -42.13 -38.9 1.82 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.631 -0.668 . . . . 0.0 111.728 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -145.26 21.82 1.54 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.998 -1.064 . . . . 0.0 111.183 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.445 ' N ' ' HD2' ' A' ' 47' ' ' PRO . 2.2 tm-20 -79.02 -55.62 0.92 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 120.993 -1.067 . . . . 0.0 110.423 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' A' ' 46' ' ' GLU . 50.3 Cg_endo -75.67 170.05 21.01 Favored 'Trans proline' 0 C--N 1.313 -1.327 0 O-C-N 123.545 1.287 . . . . 0.0 110.553 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.6 m -136.51 -40.07 0.64 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 110.358 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -95.27 -161.76 0.89 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.851 . . . . 0.0 110.311 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -61.11 -16.63 46.26 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 110.64 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -56.7 -19.07 14.72 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.221 -0.924 . . . . 0.0 110.674 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.603 ' HG2' HG21 ' A' ' 22' ' ' THR . 73.0 ttt180 -50.6 -64.95 0.65 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.266 -0.897 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.472 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -61.98 -51.88 66.28 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -44.35 -46.37 9.31 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.483 -0.76 . . . . 0.0 111.091 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.6 tpt -67.01 -28.48 68.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.097 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 30' ' ' ILE . 14.3 tp -81.93 -35.58 28.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.326 -0.859 . . . . 0.0 110.71 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.6 ' HA ' HD12 ' A' ' 60' ' ' ILE . 3.3 mm -60.49 -36.27 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.216 -0.927 . . . . 0.0 110.504 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.1 mttp -70.1 -46.35 65.02 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.276 -0.89 . . . . 0.0 110.675 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.438 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.3 OUTLIER -56.2 -24.92 44.96 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.166 -0.958 . . . . 0.0 110.652 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.6 HD12 ' HA ' ' A' ' 57' ' ' ILE . 95.3 mt -69.71 -57.48 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.229 -0.919 . . . . 0.0 109.68 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.714 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.9 mm? -78.06 -35.52 49.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.563 -0.711 . . . . 0.0 110.854 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.73 -26.27 65.5 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -65.04 0.73 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.289 -0.882 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -160.1 169.12 24.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.253 -0.904 . . . . 0.0 110.268 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -82.92 -26.4 31.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.39 -0.819 . . . . 0.0 110.237 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -63.66 -39.48 94.45 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 110.24 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 12.1 t -60.54 -31.27 70.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.286 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CE2' HG12 ' A' ' 91' ' ' ILE . 1.9 t80 -62.99 -43.03 99.92 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.371 -0.831 . . . . 0.0 109.957 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.46 -37.15 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.0 t -67.47 -35.2 78.72 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.323 -0.861 . . . . 0.0 109.968 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.582 ' CE1' HD11 ' A' ' 75' ' ' LEU . 6.3 t80 -59.26 -29.9 67.89 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.41 -0.806 . . . . 0.0 109.8 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.523 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 37.7 t80 -70.35 -49.84 45.17 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.366 -0.834 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -73.81 -29.36 62.12 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.341 -0.849 . . . . 0.0 110.452 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.31 76.77 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.339 -0.851 . . . . 0.0 110.281 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.637 HD21 ' CG2' ' A' ' 25' ' ' ILE . 21.3 mt -84.15 -36.37 22.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.376 -0.828 . . . . 0.0 110.28 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.523 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 26.6 mt -67.43 -14.83 63.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.404 -0.81 . . . . 0.0 110.54 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -54.35 -24.0 17.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.272 -0.892 . . . . 0.0 110.69 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.64 -75.05 0.61 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.271 -0.893 . . . . 0.0 110.174 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.36 55.17 0.18 Allowed Glycine 0 N--CA 1.492 2.406 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -107.5 16.17 24.09 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -1.059 . . . . 0.0 110.575 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.683 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 26.0 ttmt -47.35 -34.96 7.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.274 -0.891 . . . . 0.0 110.77 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -48.99 36.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.362 -0.836 . . . . 0.0 109.86 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.427 ' O ' HD12 ' A' ' 87' ' ' LEU . 5.6 tt -69.37 -49.89 51.26 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 109.991 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.69 -28.33 69.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.461 -0.774 . . . . 0.0 110.171 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -59.83 -42.29 93.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.835 . . . . 0.0 110.195 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.476 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 48.1 tp -65.39 -30.79 71.64 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.371 -0.831 . . . . 0.0 110.191 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.504 HD22 ' CE2' ' A' ' 71' ' ' PHE . 1.1 mt -81.82 -27.89 33.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.399 -0.813 . . . . 0.0 110.109 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -77.53 -45.97 23.81 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.421 -0.8 . . . . 0.0 110.284 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.17 -19.96 65.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.355 -0.841 . . . . 0.0 110.328 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -81.01 -17.35 72.49 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.568 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 27.8 mt -65.62 -54.67 28.4 Favored Pre-proline 0 N--CA 1.493 1.69 0 O-C-N 121.19 -1.183 . . . . 0.0 110.68 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.568 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 45.2 Cg_endo . . . . . 0 C--N 1.314 -1.258 0 O-C-N 123.331 1.174 . . . . 0.0 110.684 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.681 0 CA-C-O 121.081 0.467 . . . . 0.0 110.296 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -58.76 -41.88 87.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.305 -0.872 . . . . 0.0 110.265 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.529 ' CB ' HG23 ' A' ' 91' ' ' ILE . . . -60.13 -40.91 91.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.34 -0.85 . . . . 0.0 110.087 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -64.15 -39.51 94.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.381 -0.825 . . . . 0.0 110.013 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -70.76 -27.55 64.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.405 -0.809 . . . . 0.0 110.032 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 t -62.08 -59.42 5.1 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.398 -0.814 . . . . 0.0 110.149 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.801 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -52.51 -35.68 53.65 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.311 -0.868 . . . . 0.0 109.987 179.732 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 mt -80.75 -21.52 40.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.36 -0.837 . . . . 0.0 110.53 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -115.45 24.57 11.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.923 . . . . 0.0 110.483 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.422 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 8.2 t-80 -130.95 34.07 4.11 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.303 -0.873 . . . . 0.0 110.12 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.4 ttp-105 -71.27 -25.17 62.34 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.363 -0.836 . . . . 0.0 110.256 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.14 -34.14 69.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.238 -0.914 . . . . 0.0 110.158 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.422 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -77.95 -44.56 26.5 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.431 -0.793 . . . . 0.0 110.038 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.696 HD22 HG12 ' A' ' 57' ' ' ILE . 3.5 tp -65.28 -38.68 91.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.308 -0.87 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.58 -42.99 79.61 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.324 -0.86 . . . . 0.0 110.12 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -81.75 -24.31 36.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.367 -0.833 . . . . 0.0 110.028 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -81.16 -64.86 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.285 -0.884 . . . . 0.0 110.179 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.916 HD13 HG13 ' A' ' 25' ' ' ILE . 19.9 mt -128.59 163.17 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 0.0 110.404 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.56 ' O ' ' C ' ' A' ' 22' ' ' THR . 9.2 mttt -125.48 142.41 51.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.616 -0.677 . . . . 0.0 109.383 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.571 HG23 ' HB2' ' A' ' 53' ' ' ALA . 66.7 p -24.05 98.37 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.549 0.69 . . . . 0.0 111.075 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' TYR . 40.0 m -155.85 -175.81 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.638 . . . . 0.0 110.036 -178.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -33.01 -36.47 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.895 -0.503 . . . . 0.0 112.039 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.916 HG13 HD13 ' A' ' 20' ' ' ILE . 42.9 mm -54.61 -65.17 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 120.99 -1.069 . . . . 0.0 110.221 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.496 ' HE1' HG13 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -75.41 -35.85 60.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.349 -0.845 . . . . 0.0 110.436 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.18 -48.96 77.73 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.34 -0.85 . . . . 0.0 110.564 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -55.86 -40.5 73.0 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.224 -0.923 . . . . 0.0 110.509 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -61.36 -50.27 73.57 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.328 -0.858 . . . . 0.0 110.237 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.953 HG23 ' HB2' ' A' ' 35' ' ' LEU . 21.1 mt -58.97 -25.52 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.392 -0.817 . . . . 0.0 110.418 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.3 m -96.89 -14.69 21.63 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.355 -0.841 . . . . 0.0 110.573 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -74.98 -3.0 29.75 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.238 -0.914 . . . . 0.0 110.771 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.15 8.17 7.36 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.66 ' C ' HD22 ' A' ' 35' ' ' LEU . 19.2 m-85 -80.38 -70.36 0.53 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.115 -1.227 . . . . 0.0 110.376 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.953 ' HB2' HG23 ' A' ' 30' ' ' ILE . 3.9 mm? -108.67 164.64 12.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.387 -0.82 . . . . 0.0 110.04 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.4 p -60.83 158.66 12.56 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.324 -0.86 . . . . 0.0 110.146 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -73.91 -28.15 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.364 -0.835 . . . . 0.0 110.136 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -59.96 -30.19 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.197 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.31 -26.85 63.97 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.387 -0.821 . . . . 0.0 110.212 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -68.39 -35.18 77.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.33 -0.856 . . . . 0.0 110.156 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -69.91 -30.63 68.1 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.388 -0.82 . . . . 0.0 110.075 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -66.62 -63.5 1.06 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 110.131 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.402 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 65.0 t -47.14 -33.56 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.45 -0.781 . . . . 0.0 110.644 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -46.55 -47.55 19.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.54 -0.725 . . . . 0.0 111.369 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -145.07 13.98 1.47 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.064 -1.022 . . . . 0.0 111.309 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.64 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 15.6 tp10 -80.59 -47.64 1.23 Allowed Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.043 -1.036 . . . . 0.0 110.974 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.64 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.7 Cg_endo -76.45 169.95 20.9 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.128 1.067 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.1 m -141.13 -46.8 0.39 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.372 -0.83 . . . . 0.0 110.169 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.76 -160.2 0.47 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.288 -0.882 . . . . 0.0 110.175 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -7.55 50.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.26 -0.9 . . . . 0.0 110.453 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -61.39 -17.12 52.59 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.157 -0.964 . . . . 0.0 110.447 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.472 ' HG2' HG21 ' A' ' 22' ' ' THR . 74.5 ttt180 -50.22 -59.61 3.78 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.244 -0.91 . . . . 0.0 110.387 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.651 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -66.08 -48.06 72.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.347 -0.846 . . . . 0.0 110.001 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -49.25 -34.07 14.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.421 -0.799 . . . . 0.0 110.487 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.9 ttt -79.55 -25.14 41.73 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.429 -0.794 . . . . 0.0 109.974 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.831 HD11 ' CD1' ' A' ' 30' ' ' ILE . 14.0 tp -79.16 -49.18 12.98 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.336 -0.853 . . . . 0.0 110.105 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.696 HG12 HD22 ' A' ' 16' ' ' LEU . 2.5 mp -56.8 -30.9 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.318 -0.864 . . . . 0.0 109.997 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -75.15 -43.36 52.89 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.345 -0.847 . . . . 0.0 110.191 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 17.3 mmt -58.46 -30.96 67.35 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.419 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.621 HD12 ' HA ' ' A' ' 57' ' ' ILE . 81.7 mt -68.18 -58.0 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.02 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.422 HD21 ' HG ' ' A' ' 9' ' ' LEU . 1.5 mm? -68.66 -40.34 80.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.375 -0.828 . . . . 0.0 110.502 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -55.58 -24.97 35.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.309 -0.869 . . . . 0.0 110.572 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -63.95 0.96 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.277 -0.89 . . . . 0.0 110.263 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -160.07 167.97 26.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.295 -0.878 . . . . 0.0 110.272 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -76.61 -36.46 57.46 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.17 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.37 -28.49 69.27 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.332 -0.855 . . . . 0.0 110.124 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.427 ' HG ' ' HE2' ' A' ' 34' ' ' PHE . 2.1 t -59.82 -48.58 81.11 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.38 -0.825 . . . . 0.0 110.139 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.801 ' CE1' HD23 ' A' ' 9' ' ' LEU . 4.0 t80 -57.71 -32.35 67.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.414 -0.804 . . . . 0.0 110.179 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.57 -44.09 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.333 -0.855 . . . . 0.0 109.939 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.4 t -65.51 -32.66 74.39 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.388 -0.82 . . . . 0.0 110.002 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.464 ' CE1' HD13 ' A' ' 87' ' ' LEU . 2.6 t80 -55.66 -41.54 73.79 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.339 -0.851 . . . . 0.0 109.857 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.74 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 38.4 t80 -62.71 -43.28 99.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.31 -0.869 . . . . 0.0 110.112 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -70.49 -24.83 62.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 110.404 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.88 -52.33 37.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.26 -0.9 . . . . 0.0 110.326 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.1 mt -62.72 -38.54 90.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.345 -0.847 . . . . 0.0 110.264 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.74 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 34.1 mt -66.91 -15.17 63.49 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.398 -0.814 . . . . 0.0 110.457 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.25 -22.93 66.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.25 -0.906 . . . . 0.0 110.478 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.69 -75.17 0.64 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.205 -0.935 . . . . 0.0 110.374 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.53 36.9 0.11 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.762 ' CE2' HD11 ' A' ' 20' ' ' ILE . 28.5 m-85 -92.9 16.38 12.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.493 -1.004 . . . . 0.0 110.441 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 21.8 tttp -42.4 -30.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.413 -0.804 . . . . 0.0 111.034 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -78.83 -48.86 13.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.314 -0.866 . . . . 0.0 109.913 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.656 ' C ' HD13 ' A' ' 83' ' ' LEU . 2.7 tm? -72.71 -48.59 37.54 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.013 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.52 -34.71 72.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.387 -0.82 . . . . 0.0 110.139 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.632 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.3 -36.1 77.12 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.358 -0.839 . . . . 0.0 110.082 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 39.3 tp -61.88 -40.32 95.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.302 -0.874 . . . . 0.0 110.327 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.464 HD13 ' CE1' ' A' ' 71' ' ' PHE . 1.1 mt -74.95 -30.04 61.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.359 -0.838 . . . . 0.0 110.276 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.457 ' HA ' HD12 ' A' ' 91' ' ' ILE . 5.6 t60 -84.97 -27.03 26.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.472 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.75 -23.19 42.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.318 -0.864 . . . . 0.0 110.31 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -80.41 -24.96 58.02 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.569 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.5 mt -59.63 -56.08 39.4 Favored Pre-proline 0 N--CA 1.493 1.685 0 O-C-N 121.189 -1.183 . . . . 0.0 110.45 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.569 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo . . . . . 0 C--N 1.313 -1.307 0 O-C-N 123.274 1.144 . . . . 0.0 110.705 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.137 0.494 . . . . 0.0 110.414 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 ttmm -59.99 -34.98 74.05 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.349 -0.844 . . . . 0.0 110.552 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.43 82.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.234 -0.916 . . . . 0.0 110.139 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.449 ' O ' HD12 ' A' ' 10' ' ' LEU . 56.0 ttp180 -64.77 -31.75 73.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.333 -0.854 . . . . 0.0 109.997 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -74.88 -27.65 60.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.427 -0.796 . . . . 0.0 109.818 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 t -62.01 -50.65 71.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.431 -0.793 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.674 ' O ' HD13 ' A' ' 9' ' ' LEU . 2.1 tm? -59.38 -38.48 80.62 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.35 -0.844 . . . . 0.0 109.871 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 6' ' ' ARG . 12.0 mt -72.5 -30.69 64.73 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.334 -0.854 . . . . 0.0 110.147 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -81.97 -4.66 57.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.348 -0.845 . . . . 0.0 110.639 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.862 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 9.7 t-160 -96.38 34.01 1.69 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.233 -0.917 . . . . 0.0 110.25 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -75.8 -41.57 52.43 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.846 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.28 -35.67 27.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.208 -0.933 . . . . 0.0 110.953 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.862 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -75.13 -25.85 58.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.077 -1.015 . . . . 0.0 110.267 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.576 HD11 ' CE ' ' A' ' 26' ' ' MET . 7.1 tt -85.28 -29.28 24.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.87 . . . . 0.0 109.831 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.69 -38.19 86.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 ttmt -84.34 -31.54 24.74 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 110.345 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -84.46 -65.54 1.0 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.312 -0.867 . . . . 0.0 110.364 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.534 HD12 HG13 ' A' ' 25' ' ' ILE . 15.2 mm -108.99 109.56 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.388 -0.82 . . . . 0.0 110.224 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.559 ' O ' ' C ' ' A' ' 22' ' ' THR . 34.3 mtpt -100.56 141.4 33.47 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.509 -0.744 . . . . 0.0 109.438 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.689 HG22 HD22 ' A' ' 56' ' ' LEU . 73.2 p -25.02 97.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.302 0 CA-C-O 121.49 0.662 . . . . 0.0 111.122 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 7.8 t -160.34 -176.25 5.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.473 -0.767 . . . . 0.0 110.285 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.444 ' CD1' ' HB2' ' A' ' 28' ' ' HIS . 9.2 t80 -33.28 -39.25 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.859 -0.526 . . . . 0.0 111.866 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.534 HG13 HD12 ' A' ' 20' ' ' ILE . 46.2 mm -57.74 -64.1 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.044 -1.035 . . . . 0.0 110.029 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.748 ' HB3' HD21 ' A' ' 56' ' ' LEU . 7.5 mmt -75.23 -34.36 61.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.323 -0.861 . . . . 0.0 110.198 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -59.38 4.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.456 -0.777 . . . . 0.0 110.402 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . 11.4 t-80 -54.52 -24.92 22.75 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.329 -0.857 . . . . 0.0 110.474 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.41 ' O ' ' CD2' ' A' ' 34' ' ' PHE . 33.8 mtt -72.41 -38.58 68.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -0.909 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.732 HD11 HD11 ' A' ' 56' ' ' LEU . 82.5 mt -61.39 -50.18 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.248 -0.908 . . . . 0.0 110.049 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.8 m -74.76 -15.57 60.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 110.455 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.45 -25.49 50.84 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.276 -0.89 . . . . 0.0 110.431 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 139.45 -13.72 3.22 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.484 ' CB ' HD12 ' A' ' 35' ' ' LEU . 17.4 m-30 -58.56 -61.83 2.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.14 -1.212 . . . . 0.0 110.44 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.708 HD22 ' OE1' ' A' ' 39' ' ' GLU . 3.9 mp -125.46 165.19 18.89 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.264 -0.897 . . . . 0.0 110.423 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 p -57.23 173.53 0.24 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.446 -0.784 . . . . 0.0 110.397 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.544 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.3 mp -85.35 -21.44 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.424 -0.797 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.9 m -57.91 -27.21 63.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.279 -0.888 . . . . 0.0 110.315 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.708 ' OE1' HD22 ' A' ' 35' ' ' LEU . 38.3 tt0 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.391 -0.818 . . . . 0.0 110.149 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -62.12 -32.26 72.81 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.361 -0.837 . . . . 0.0 110.114 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.84 -32.13 69.06 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.391 -0.818 . . . . 0.0 110.167 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -75.58 -54.94 6.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.06 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.6 t -53.36 -33.85 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.379 -0.826 . . . . 0.0 110.47 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -46.7 -36.57 7.29 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.378 -0.826 . . . . 0.0 110.878 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -144.17 20.8 1.75 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.282 -0.886 . . . . 0.0 110.543 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.7 tt0 -81.91 -57.02 0.53 Allowed Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 0.0 110.741 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 46.7 Cg_endo -72.49 170.09 20.19 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 O-C-N 123.307 1.162 . . . . 0.0 110.631 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 27.0 m -140.79 -43.03 0.39 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.436 -0.79 . . . . 0.0 110.1 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -98.33 -154.35 0.46 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.443 -0.786 . . . . 0.0 110.055 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -66.61 -12.55 58.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.281 -0.887 . . . . 0.0 110.609 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -57.47 -19.29 23.27 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.246 -0.909 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.612 ' HG2' HG21 ' A' ' 22' ' ' THR . 2.1 ttt85 -51.62 -36.41 45.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.275 -0.89 . . . . 0.0 110.715 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.423 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -85.98 -18.0 33.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 110.528 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -83.34 -34.49 25.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.179 -0.95 . . . . 0.0 110.287 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 0.473 ' HG2' ' HE1' ' A' ' 59' ' ' MET . 0.7 OUTLIER -77.52 -47.78 18.69 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.342 -0.849 . . . . 0.0 110.427 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.748 HD21 ' HB3' ' A' ' 26' ' ' MET . 17.7 tp -55.76 -40.76 73.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.355 -0.84 . . . . 0.0 110.548 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.655 ' HA ' HD12 ' A' ' 60' ' ' ILE . 0.9 OUTLIER -67.88 -26.4 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.337 -0.852 . . . . 0.0 109.957 179.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.3 mtmm -70.9 -48.76 51.92 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.233 -0.917 . . . . 0.0 109.924 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 0.473 ' HE1' ' HG2' ' A' ' 55' ' ' MET . 0.0 OUTLIER -52.77 -30.52 33.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.295 -0.878 . . . . 0.0 110.447 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.655 HD12 ' HA ' ' A' ' 57' ' ' ILE . 85.1 mt -63.88 -53.01 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.329 -0.857 . . . . 0.0 109.873 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.516 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.7 mm? -82.17 -27.31 32.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.458 -0.776 . . . . 0.0 110.699 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -60.74 -29.59 69.48 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.385 -0.822 . . . . 0.0 110.529 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -76.01 -65.07 0.96 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.24 -0.913 . . . . 0.0 110.389 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.28 169.99 22.05 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 0.0 110.218 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -80.58 -21.68 41.44 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.37 -0.831 . . . . 0.0 110.312 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -61.06 -39.37 89.59 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.18 -0.95 . . . . 0.0 110.232 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.4 t -60.11 -28.41 67.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.333 -0.854 . . . . 0.0 110.139 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.585 ' HE1' HD23 ' A' ' 9' ' ' LEU . 16.2 t80 -70.4 -35.83 73.7 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 109.954 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.59 -41.68 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.118 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.3 t -63.73 -36.84 85.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.299 -0.876 . . . . 0.0 110.182 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.574 ' CE1' HD22 ' A' ' 87' ' ' LEU . 5.9 t80 -57.05 -38.3 73.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.398 -0.814 . . . . 0.0 110.175 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.677 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 35.2 t80 -64.23 -43.33 95.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 110.372 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -76.84 -25.4 53.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.366 -0.834 . . . . 0.0 110.477 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.19 -35.84 80.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.284 -0.885 . . . . 0.0 110.45 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.536 HD11 ' CE2' ' A' ' 71' ' ' PHE . 11.6 mt -80.22 -40.98 26.02 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.607 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 39.2 mt -66.58 -14.97 63.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.712 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -63.71 -22.78 67.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.244 -0.91 . . . . 0.0 110.547 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -109.91 -75.27 0.63 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.207 -0.933 . . . . 0.0 110.459 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.04 37.0 0.1 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -94.45 16.47 15.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.506 -0.996 . . . . 0.0 110.588 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 38.5 ttpt -41.49 -32.39 0.33 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.483 -0.761 . . . . 0.0 110.929 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -67.35 -47.42 70.49 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.344 -0.848 . . . . 0.0 109.63 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.537 HD13 ' O ' ' A' ' 83' ' ' LEU . 1.1 tm? -69.94 -51.42 32.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.47 -0.769 . . . . 0.0 109.829 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.677 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.26 -30.04 69.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.44 -0.787 . . . . 0.0 110.202 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.604 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -58.83 -41.35 86.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.32 -0.863 . . . . 0.0 110.124 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.356 -0.84 . . . . 0.0 110.173 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.574 HD22 ' CE1' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -70.34 -34.48 72.7 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.318 -0.864 . . . . 0.0 110.214 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.455 ' HA ' HD12 ' A' ' 91' ' ' ILE . 13.9 t-80 -77.87 -16.63 58.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.348 -0.845 . . . . 0.0 110.493 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.15 -14.97 45.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.293 -0.879 . . . . 0.0 110.545 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -109.58 -22.82 6.53 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.568 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 19.3 mt -59.93 -57.39 27.12 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.198 -1.177 . . . . 0.0 110.437 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.568 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.2 Cg_endo . . . . . 0 C--N 1.313 -1.322 0 O-C-N 123.267 1.14 . . . . 0.0 110.564 179.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.73 0 CA-C-O 121.238 0.542 . . . . 0.0 110.271 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -58.16 -41.02 82.92 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.381 -0.824 . . . . 0.0 110.301 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -68.0 -41.18 82.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.335 -0.853 . . . . 0.0 110.091 179.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -66.82 -32.87 74.43 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.365 -0.834 . . . . 0.0 110.07 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -75.23 -27.78 59.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.344 -0.848 . . . . 0.0 110.283 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.3 t -60.68 -58.35 8.84 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.261 -0.899 . . . . 0.0 110.111 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.757 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -57.58 -34.71 69.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.379 -0.826 . . . . 0.0 110.046 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.1 mt -81.27 -21.2 39.56 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.343 -0.848 . . . . 0.0 110.471 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -116.66 53.67 0.88 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.306 -0.871 . . . . 0.0 110.427 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.491 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 4.5 t-160 -159.78 42.37 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.333 -0.854 . . . . 0.0 109.772 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.533 ' CD ' ' HB2' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -75.15 -33.78 61.55 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.474 -0.766 . . . . 0.0 110.565 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -58.99 -35.49 73.31 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.217 -0.927 . . . . 0.0 110.23 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.491 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -85.43 -34.98 21.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.433 -0.792 . . . . 0.0 110.141 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.631 ' C ' HD13 ' A' ' 16' ' ' LEU . 3.0 tm? -64.1 -46.41 84.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.387 -0.821 . . . . 0.0 109.871 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -61.65 -43.52 98.7 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.492 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -66.11 -42.29 89.41 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.362 -0.836 . . . . 0.0 110.524 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.569 ' CG ' HD23 ' A' ' 83' ' ' LEU . 19.9 m-20 -80.28 -64.87 1.09 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.398 -0.814 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.774 HD12 HG13 ' A' ' 25' ' ' ILE . 24.9 mm -102.79 166.26 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.313 -0.867 . . . . 0.0 110.203 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.536 ' O ' ' C ' ' A' ' 22' ' ' THR . 38.9 mtmt -153.64 141.14 19.8 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.46 -0.775 . . . . 0.0 109.531 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.571 HG21 ' HG2' ' A' ' 52' ' ' ARG . 70.7 p -25.85 94.65 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 121.455 0.645 . . . . 0.0 111.175 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 21' ' ' LYS . 26.5 m -165.23 -175.85 3.82 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.632 -0.667 . . . . 0.0 109.923 -178.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.44 ' C ' ' O ' ' A' ' 23' ' ' SER . 7.9 t80 -33.66 -34.72 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.883 -0.511 . . . . 0.0 111.841 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.774 HG13 HD12 ' A' ' 20' ' ' ILE . 44.2 mm -53.49 -65.46 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.063 -1.023 . . . . 0.0 110.027 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.63 ' HE1' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -75.78 -37.9 58.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.23 -0.918 . . . . 0.0 110.216 179.55 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -57.65 -50.37 73.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.7 -33.17 69.88 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.247 -0.908 . . . . 0.0 110.075 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.0 mtt -68.41 -58.08 4.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.512 -0.742 . . . . 0.0 110.008 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.75 HG23 ' HB2' ' A' ' 35' ' ' LEU . 8.3 mt -56.47 -27.33 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.392 -0.817 . . . . 0.0 110.07 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 33.5 m -88.67 -22.62 23.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.344 -0.847 . . . . 0.0 110.261 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -59.76 -26.82 66.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.328 -0.858 . . . . 0.0 110.33 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.64 -15.2 2.91 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.546 ' CB ' HD12 ' A' ' 35' ' ' LEU . 25.0 m-85 -57.82 -47.67 81.95 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -1.175 . . . . 0.0 110.35 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.75 ' HB2' HG23 ' A' ' 30' ' ' ILE . 4.7 mp -132.07 165.13 24.7 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.347 -0.845 . . . . 0.0 110.387 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -70.43 171.85 9.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.39 -0.819 . . . . 0.0 110.265 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 49.4 mm -84.96 -18.77 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.824 . . . . 0.0 110.35 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.0 m -55.79 -26.25 45.21 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.24 -0.912 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.423 ' O ' HG23 ' A' ' 43' ' ' VAL . 26.9 tt0 -73.64 -28.03 61.57 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -71.56 -41.69 68.75 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.363 -0.835 . . . . 0.0 110.246 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -64.15 -27.69 69.25 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.32 -0.862 . . . . 0.0 110.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -80.19 -60.98 2.12 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.173 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 39' ' ' GLU . 65.3 t -48.41 -33.85 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.442 -0.787 . . . . 0.0 110.668 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -46.62 -42.72 16.61 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.464 -0.772 . . . . 0.0 111.173 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -145.22 17.25 1.54 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.114 -0.991 . . . . 0.0 110.974 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.63 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.1 OUTLIER -79.55 -47.66 1.5 Allowed Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.048 -1.033 . . . . 0.0 110.721 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -77.13 170.08 20.31 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.262 1.138 . . . . 0.0 110.334 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.8 m -129.25 -41.46 1.4 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.386 -0.821 . . . . 0.0 110.355 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -98.41 -159.61 0.75 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.355 -0.84 . . . . 0.0 110.363 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -65.74 -12.13 51.35 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.369 -0.832 . . . . 0.0 110.715 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -55.63 -20.03 12.43 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.152 -0.967 . . . . 0.0 110.678 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.571 ' HG2' HG21 ' A' ' 22' ' ' THR . 24.3 ttp180 -49.65 -37.43 28.28 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.177 -0.952 . . . . 0.0 110.592 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.771 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -79.1 -53.04 7.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.367 -0.833 . . . . 0.0 110.113 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.533 ' HB2' ' CD ' ' A' ' 13' ' ' ARG . . . -50.45 -26.47 5.12 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.44 -0.788 . . . . 0.0 110.619 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.8 tpt -82.99 -28.04 29.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.318 -0.864 . . . . 0.0 110.241 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.447 HD11 HD13 ' A' ' 30' ' ' ILE . 14.0 tp -84.89 -50.85 7.17 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.771 HD12 ' O ' ' A' ' 53' ' ' ALA . 2.7 mp -58.93 -36.66 62.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.328 -0.858 . . . . 0.0 110.072 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -66.56 -37.53 85.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.323 -0.861 . . . . 0.0 109.929 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.7 mmt -61.27 -27.79 68.71 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.413 -0.804 . . . . 0.0 110.14 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.689 HD12 ' HA ' ' A' ' 57' ' ' ILE . 87.0 mt -66.72 -53.62 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.354 -0.841 . . . . 0.0 109.889 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.423 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -77.47 -34.06 54.45 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.51 -0.744 . . . . 0.0 110.535 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -25.08 67.5 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.279 -0.888 . . . . 0.0 110.339 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -77.35 -64.51 1.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 110.355 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -153.6 166.49 32.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.388 -0.82 . . . . 0.0 110.371 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -85.21 -25.33 27.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.8 . . . . 0.0 110.246 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.48 -35.25 71.9 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.338 -0.851 . . . . 0.0 110.382 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.8 t -64.45 -34.07 77.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.354 -0.841 . . . . 0.0 110.127 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.609 ' HE1' HD23 ' A' ' 9' ' ' LEU . 18.5 t80 -60.58 -44.89 95.71 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.4 -0.812 . . . . 0.0 110.023 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.15 -34.29 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.804 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.8 t -73.58 -29.43 62.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.41 -0.806 . . . . 0.0 109.978 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.612 ' CE2' HD11 ' A' ' 75' ' ' LEU . 10.4 t80 -57.47 -44.54 84.93 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.499 -0.751 . . . . 0.0 109.771 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.583 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 46.3 t80 -61.05 -45.79 93.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.459 -0.776 . . . . 0.0 110.072 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -76.42 -23.58 53.99 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.351 -0.843 . . . . 0.0 110.577 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.89 -32.01 70.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.612 HD11 ' CE2' ' A' ' 71' ' ' PHE . 3.9 mt -84.9 -39.23 18.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.204 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.583 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 23.0 mt -67.2 -14.73 63.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.408 -0.808 . . . . 0.0 110.524 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 -56.78 -24.75 52.65 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.0 110.643 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -116.78 -75.08 0.58 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.167 -0.958 . . . . 0.0 110.394 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.37 67.35 0.14 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -125.08 16.37 8.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.406 -1.056 . . . . 0.0 110.509 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ttmt -44.34 -30.93 0.91 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.473 -0.767 . . . . 0.0 110.96 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.61 -49.12 67.34 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.355 -0.841 . . . . 0.0 109.791 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.659 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.1 tm? -78.84 -40.49 32.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.427 -0.795 . . . . 0.0 109.798 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.438 ' HB3' HD21 ' A' ' 76' ' ' LEU . . . -60.37 -45.91 91.83 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.1 -29.21 70.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.334 -0.854 . . . . 0.0 110.07 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 86' ' ' LEU . 23.2 tp -59.99 -50.19 74.72 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.446 -0.783 . . . . 0.0 110.212 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 mp -77.4 -25.3 50.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.258 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.472 ' HA ' HD12 ' A' ' 91' ' ' ILE . 2.0 t60 -68.74 -41.11 79.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.303 -0.873 . . . . 0.0 110.359 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.62 -22.19 64.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.259 -0.901 . . . . 0.0 110.543 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -84.9 -19.71 59.03 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.566 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.8 mt -60.67 -53.91 59.83 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.171 -1.193 . . . . 0.0 110.576 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.566 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.4 Cg_endo . . . . . 0 C--N 1.313 -1.317 0 O-C-N 123.271 1.143 . . . . 0.0 110.547 179.904 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.051 0.453 . . . . 0.0 110.458 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -55.08 -34.64 63.78 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.283 -0.886 . . . . 0.0 110.379 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.56 -39.04 92.38 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -63.8 -30.24 71.36 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.388 -0.82 . . . . 0.0 109.851 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -72.82 -37.14 67.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.493 -0.754 . . . . 0.0 109.959 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.8 t -63.27 -50.18 71.15 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.374 -0.829 . . . . 0.0 110.156 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.759 ' O ' HD13 ' A' ' 9' ' ' LEU . 1.5 tm? -60.18 -36.58 77.92 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.277 -0.889 . . . . 0.0 109.913 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.9 mt -68.23 -31.04 70.25 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.85 . . . . 0.0 109.961 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -97.07 22.9 7.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.403 -0.81 . . . . 0.0 110.16 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.664 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 6.8 t60 -107.97 23.25 14.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.898 . . . . 0.0 110.331 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.584 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 49.1 ttp180 -67.94 -47.5 68.53 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.232 -0.917 . . . . 0.0 110.003 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.71 -35.38 77.88 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.362 -0.836 . . . . 0.0 110.111 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.664 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -78.81 -43.87 24.37 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.399 -0.813 . . . . 0.0 110.074 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.898 HD21 ' CE ' ' A' ' 26' ' ' MET . 2.3 tm? -59.09 -50.36 74.36 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.296 -0.878 . . . . 0.0 109.692 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.91 -54.07 51.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.335 -0.853 . . . . 0.0 110.225 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -61.84 -27.55 68.86 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.29 -0.881 . . . . 0.0 110.167 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.697 ' HB3' HD11 ' A' ' 83' ' ' LEU . 63.6 m-20 -85.1 -65.19 1.04 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.41 -0.806 . . . . 0.0 110.317 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.905 HD13 HG13 ' A' ' 25' ' ' ILE . 22.1 mt -134.38 147.12 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.307 -0.87 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.58 ' O ' ' C ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -106.44 141.98 36.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.562 -0.711 . . . . 0.0 109.298 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.58 ' C ' ' O ' ' A' ' 21' ' ' LYS . 81.8 p -24.17 98.49 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.493 0.663 . . . . 0.0 110.891 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 24' ' ' TYR . 3.3 m -152.22 -175.68 5.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.69 -0.631 . . . . 0.0 110.183 -178.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.425 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -32.91 -37.43 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.896 -0.503 . . . . 0.0 112.064 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.905 HG13 HD13 ' A' ' 20' ' ' ILE . 44.3 mm -52.45 -65.25 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.901 -1.125 . . . . 0.0 110.169 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.898 ' CE ' HD21 ' A' ' 16' ' ' LEU . 2.1 mpt? -75.16 -50.49 16.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.891 . . . . 0.0 110.392 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -47.44 -51.53 19.86 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.526 -0.734 . . . . 0.0 111.228 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -55.26 -40.09 70.56 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.193 -0.942 . . . . 0.0 110.181 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.419 ' HE1' ' HB2' ' A' ' 71' ' ' PHE . 42.9 mtp -68.11 -32.52 72.87 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.398 -0.814 . . . . 0.0 110.433 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.492 HG23 ' HB2' ' A' ' 35' ' ' LEU . 39.7 mm -61.94 -65.43 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.34 -0.85 . . . . 0.0 110.405 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.2 m -59.94 -19.27 51.0 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.426 -0.796 . . . . 0.0 110.691 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -22.37 32.29 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.18 -0.95 . . . . 0.0 110.407 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.86 -14.53 3.35 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.722 ' C ' HD22 ' A' ' 35' ' ' LEU . 15.0 m-30 -60.91 -67.76 0.37 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.177 -1.19 . . . . 0.0 110.441 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.722 HD22 ' C ' ' A' ' 34' ' ' PHE . 3.8 mm? -113.25 150.05 32.94 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 110.251 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.8 p -62.58 175.18 0.83 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.393 -0.817 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.561 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.7 mp -77.68 -15.64 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.426 -0.797 . . . . 0.0 110.497 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.3 m -61.77 -31.25 71.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.236 -0.915 . . . . 0.0 110.415 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -70.92 -31.05 67.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.329 -0.857 . . . . 0.0 110.274 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -75.16 -27.67 59.81 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.34 -0.85 . . . . 0.0 110.433 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.76 -35.53 77.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.183 -0.948 . . . . 0.0 110.362 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -77.7 -59.75 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.228 -0.92 . . . . 0.0 110.265 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 78.8 t -47.42 -33.44 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.406 -0.809 . . . . 0.0 110.593 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -46.67 -53.17 12.22 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.588 -0.695 . . . . 0.0 111.505 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.82 4.75 2.57 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.05 -1.031 . . . . 0.0 111.645 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.578 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.9 tp10 -75.2 -47.49 4.49 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 120.917 -1.115 . . . . 0.0 110.884 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.0 Cg_endo -74.84 169.99 21.36 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.189 1.099 . . . . 0.0 110.455 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -152.65 -50.37 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.376 -0.827 . . . . 0.0 110.103 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.05 -160.71 0.3 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.379 -0.826 . . . . 0.0 110.076 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -66.76 -13.82 61.87 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.417 -0.802 . . . . 0.0 110.501 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -62.76 -16.29 57.18 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.494 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -51.82 -60.66 2.91 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.249 -0.907 . . . . 0.0 110.518 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.437 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -72.7 -48.37 39.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.324 -0.86 . . . . 0.0 110.299 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.584 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -46.76 -35.53 6.27 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.434 -0.791 . . . . 0.0 110.781 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -82.05 -25.02 34.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.364 -0.835 . . . . 0.0 109.932 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.412 HD23 HG22 ' A' ' 22' ' ' THR . 32.3 tp -80.17 -39.4 29.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 0.0 110.23 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.544 ' HA ' HD12 ' A' ' 60' ' ' ILE . 32.7 mm -63.37 -38.74 82.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 109.933 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.74 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 109.74 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.7 mmt -59.43 -27.81 66.38 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.404 -0.81 . . . . 0.0 110.012 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.544 HD12 ' HA ' ' A' ' 57' ' ' ILE . 91.5 mt -66.99 -49.81 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.515 -0.741 . . . . 0.0 109.959 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.415 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.5 mm? -80.69 -29.21 36.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.475 -0.766 . . . . 0.0 110.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -61.28 -28.92 69.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.317 -0.864 . . . . 0.0 110.451 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -65.27 0.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.386 -0.821 . . . . 0.0 110.249 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -160.24 170.1 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.397 -0.815 . . . . 0.0 110.187 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -81.31 -28.87 34.41 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.382 -0.824 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -61.69 -36.85 82.08 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.351 -0.843 . . . . 0.0 110.251 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 t -59.8 -37.46 79.18 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.658 ' CE1' HD23 ' A' ' 9' ' ' LEU . 11.6 t80 -60.31 -36.29 77.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.328 -0.857 . . . . 0.0 109.862 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.7 t -65.23 -35.58 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.42 -0.8 . . . . 0.0 109.856 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.1 t -69.58 -37.11 76.83 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.401 -0.812 . . . . 0.0 110.046 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.789 ' CE1' HD11 ' A' ' 75' ' ' LEU . 21.5 t80 -52.41 -39.67 61.21 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.429 -0.795 . . . . 0.0 109.918 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.751 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 47.2 t80 -62.46 -51.95 65.48 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.996 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -72.68 -20.6 61.21 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.324 -0.86 . . . . 0.0 110.562 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.78 -41.28 83.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.26 -0.9 . . . . 0.0 110.368 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.789 HD11 ' CE1' ' A' ' 71' ' ' PHE . 2.1 mt -80.03 -35.72 36.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.326 -0.858 . . . . 0.0 110.196 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.542 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 32.2 mt -65.0 -15.55 62.42 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.391 -0.818 . . . . 0.0 110.389 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -58.19 -21.36 47.2 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.203 -0.935 . . . . 0.0 110.467 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -116.96 -75.05 0.58 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.337 -0.852 . . . . 0.0 110.288 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.59 67.74 0.12 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 0.443 ' CZ ' HD11 ' A' ' 20' ' ' ILE . 12.3 m-85 -125.14 16.39 8.44 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.409 -1.053 . . . . 0.0 110.565 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.633 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 67.3 tttt -45.0 -37.55 4.12 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.319 -0.863 . . . . 0.0 110.814 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.64 -44.54 77.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.279 -0.888 . . . . 0.0 109.734 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.697 HD11 ' HB3' ' A' ' 19' ' ' ASP . 4.2 tt -70.24 -53.88 15.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.454 -0.779 . . . . 0.0 109.796 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.751 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.75 -26.58 67.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.431 -0.793 . . . . 0.0 110.322 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.633 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.36 -43.93 96.06 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.346 -0.846 . . . . 0.0 110.154 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.708 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.54 -43.13 99.42 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.363 -0.835 . . . . 0.0 109.852 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.472 HD12 ' O ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -73.33 -34.16 65.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.401 -0.812 . . . . 0.0 110.296 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.59 ' HA ' HD12 ' A' ' 91' ' ' ILE . 54.3 t-80 -70.01 -48.1 59.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.415 -0.803 . . . . 0.0 110.168 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.62 -18.93 61.48 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.361 -0.837 . . . . 0.0 110.405 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.45 -21.81 53.02 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.613 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 57.3 mt -59.26 -52.55 73.66 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.223 -1.163 . . . . 0.0 110.594 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.613 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.9 Cg_endo . . . . . 0 C--N 1.313 -1.293 0 O-C-N 123.328 1.173 . . . . 0.0 110.755 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.744 0 CA-C-O 121.202 0.525 . . . . 0.0 110.325 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.5 ttmt -51.08 -39.15 55.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.348 -0.845 . . . . 0.0 110.784 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -64.12 -41.23 97.32 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.242 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -67.39 -30.63 70.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.313 -0.867 . . . . 0.0 110.052 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -72.07 -27.43 62.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.375 -0.828 . . . . 0.0 110.062 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -63.21 -56.5 16.15 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.426 -0.796 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.749 ' O ' HD13 ' A' ' 9' ' ' LEU . 1.1 tm? -62.06 -34.8 76.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.414 -0.804 . . . . 0.0 109.777 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.5 mt -65.79 -33.67 76.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.34 -0.85 . . . . 0.0 110.014 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -94.04 18.9 9.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.333 -0.854 . . . . 0.0 110.267 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.412 ' CD2' ' O ' ' A' ' 12' ' ' HIS . 52.0 t60 -103.45 26.24 8.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.924 . . . . 0.0 110.055 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.531 ' CD ' ' HB1' ' A' ' 54' ' ' ALA . 61.4 ttp180 -75.07 -50.47 16.33 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 110.063 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.94 -33.78 70.99 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.379 -0.826 . . . . 0.0 110.307 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -46.97 26.25 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.359 -0.838 . . . . 0.0 110.058 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.594 ' C ' HD13 ' A' ' 16' ' ' LEU . 3.4 tm? -57.44 -41.55 80.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.396 -0.815 . . . . 0.0 110.185 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.32 -45.4 76.33 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.34 -0.85 . . . . 0.0 110.454 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -85.2 -23.42 28.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.27 -0.893 . . . . 0.0 110.495 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.584 ' HB3' HD11 ' A' ' 83' ' ' LEU . 6.2 m-20 -74.11 -65.24 0.87 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.303 -0.873 . . . . 0.0 110.419 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.698 HD13 HG13 ' A' ' 25' ' ' ILE . 24.1 mt -146.9 143.35 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.322 -0.862 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.57 ' O ' ' C ' ' A' ' 22' ' ' THR . 8.4 mttt -94.78 142.57 27.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.589 -0.695 . . . . 0.0 109.162 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.57 ' C ' ' O ' ' A' ' 21' ' ' LYS . 80.9 p -23.5 97.58 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.618 -0.676 . . . . 0.0 110.921 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.2 t -146.32 -176.02 5.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.628 -0.67 . . . . 0.0 110.38 -178.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' SER . 13.8 t80 -33.15 -37.98 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.963 -0.46 . . . . 0.0 111.941 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.698 HG13 HD13 ' A' ' 20' ' ' ILE . 45.3 mm -57.5 -65.56 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.99 -1.069 . . . . 0.0 109.859 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.457 ' CE ' HD12 ' A' ' 57' ' ' ILE . 11.4 mmt -75.73 -25.27 56.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.459 -0.776 . . . . 0.0 110.323 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -71.15 -54.51 10.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.414 -0.804 . . . . 0.0 110.412 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.88 -32.62 63.86 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.292 -0.88 . . . . 0.0 110.378 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.8 mtp -62.48 -44.31 96.69 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 110.326 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.555 HG21 ' HB2' ' A' ' 40' ' ' GLU . 69.6 mt -63.82 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.397 -0.814 . . . . 0.0 110.199 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.4 m -79.53 -25.12 41.78 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.34 -0.85 . . . . 0.0 110.328 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.96 -20.72 55.05 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.242 -0.911 . . . . 0.0 110.363 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.07 -13.48 3.07 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.672 ' C ' HD12 ' A' ' 35' ' ' LEU . 7.9 m-30 -54.17 -66.6 0.37 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.207 -1.172 . . . . 0.0 110.4 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.672 HD12 ' C ' ' A' ' 34' ' ' PHE . 6.3 mp -128.34 165.19 21.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.358 -0.839 . . . . 0.0 110.212 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.7 p -56.31 154.4 8.23 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.399 -0.813 . . . . 0.0 110.396 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . 0.43 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.2 mp -77.16 -23.66 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.405 -0.81 . . . . 0.0 110.32 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.1 m -64.59 -37.34 87.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.384 -0.822 . . . . 0.0 110.169 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.478 ' OE1' HD23 ' A' ' 35' ' ' LEU . 38.0 tt0 -68.1 -25.58 65.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.257 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.555 ' HB2' HG21 ' A' ' 30' ' ' ILE . 1.7 tt0 -74.95 -31.88 61.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.302 -0.874 . . . . 0.0 110.412 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.76 -32.42 72.99 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.336 -0.853 . . . . 0.0 110.306 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.23 -40.09 78.13 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.363 -0.835 . . . . 0.0 110.11 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 1.005 HG11 HD13 ' A' ' 56' ' ' LEU . 83.9 t -59.36 -34.35 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.366 -0.834 . . . . 0.0 110.265 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.07 -30.75 6.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.502 -0.749 . . . . 0.0 111.04 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -145.2 20.25 1.57 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.218 -0.926 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.546 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 10.3 tt0 -79.92 -57.24 0.69 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.096 -1.003 . . . . 0.0 110.355 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.546 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 47.7 Cg_endo -72.99 170.26 20.21 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 O-C-N 123.347 1.183 . . . . 0.0 110.52 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.8 m -131.07 -41.8 1.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -87.85 -162.38 0.81 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.362 -0.836 . . . . 0.0 110.224 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -71.46 -9.18 57.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.337 -0.852 . . . . 0.0 110.568 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -60.25 -17.51 42.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.544 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -50.94 -49.53 59.61 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.213 -0.929 . . . . 0.0 110.683 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.79 -61.82 1.7 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.894 . . . . 0.0 110.512 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.531 ' HB1' ' CD ' ' A' ' 13' ' ' ARG . . . -48.85 -39.6 26.3 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.498 -0.751 . . . . 0.0 111.036 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 ttm -65.34 -45.2 85.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 1.005 HD13 HG11 ' A' ' 43' ' ' VAL . 14.8 tp -59.25 -34.84 72.7 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.362 -0.836 . . . . 0.0 110.714 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.691 ' HA ' HD12 ' A' ' 60' ' ' ILE . 6.8 mm -61.19 -36.12 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 110.482 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -45.52 93.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.176 -0.953 . . . . 0.0 110.043 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.41 -28.86 46.62 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.287 -0.883 . . . . 0.0 110.463 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 57' ' ' ILE . 86.6 mt -65.82 -54.69 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.39 -0.819 . . . . 0.0 109.841 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -79.35 -30.31 42.59 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.468 -0.77 . . . . 0.0 110.715 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -58.96 -25.01 63.16 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.284 -0.885 . . . . 0.0 110.611 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.64 ' HB2' HD11 ' A' ' 35' ' ' LEU . 11.4 tttt -72.61 -65.29 0.81 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.312 -0.868 . . . . 0.0 110.367 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -160.25 170.12 21.79 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.271 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -75.47 -29.81 59.71 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.371 -0.831 . . . . 0.0 110.128 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -62.84 -33.75 75.89 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.357 -0.839 . . . . 0.0 110.309 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 t -60.2 -26.85 66.69 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.37 -0.831 . . . . 0.0 110.159 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.718 ' HE1' HD23 ' A' ' 9' ' ' LEU . 13.8 t80 -75.86 -37.62 58.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.415 -0.803 . . . . 0.0 110.111 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -70.5 -37.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.895 . . . . 0.0 110.164 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.0 t -69.04 -37.66 78.69 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.324 -0.86 . . . . 0.0 110.279 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.479 ' HE2' HD22 ' A' ' 87' ' ' LEU . 5.8 t80 -54.99 -40.77 70.43 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.266 -0.896 . . . . 0.0 109.879 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.528 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 29.1 t80 -61.71 -38.94 89.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.308 -0.87 . . . . 0.0 109.947 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -78.27 -23.8 47.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.388 -0.82 . . . . 0.0 110.482 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.2 81.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.265 -0.897 . . . . 0.0 110.367 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.0 mt -77.78 -37.33 49.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.344 -0.847 . . . . 0.0 110.114 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.528 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 39.6 mt -65.84 -15.05 62.54 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.453 -0.78 . . . . 0.0 110.467 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -63.4 -31.85 73.12 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -100.75 -75.68 0.58 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.26 -0.9 . . . . 0.0 110.519 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.26 35.31 0.1 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -94.71 16.01 16.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.445 -1.032 . . . . 0.0 110.484 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 26.9 tttt -47.79 -31.36 4.81 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.342 -0.849 . . . . 0.0 110.677 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.62 -54.47 23.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.405 -0.809 . . . . 0.0 109.807 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.584 HD11 ' HB3' ' A' ' 19' ' ' ASP . 5.6 tt -73.22 -41.19 64.02 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.411 -0.806 . . . . 0.0 109.928 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.93 82.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.42 -0.8 . . . . 0.0 109.924 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -61.25 -35.18 76.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.389 -0.82 . . . . 0.0 110.126 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.39 -42.22 91.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.331 -0.856 . . . . 0.0 110.23 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.479 HD22 ' HE2' ' A' ' 71' ' ' PHE . 0.9 OUTLIER -71.41 -42.81 67.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.409 -0.807 . . . . 0.0 110.232 -179.949 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.727 ' HA ' HD12 ' A' ' 91' ' ' ILE . 21.1 t60 -66.03 -32.92 74.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.385 -0.822 . . . . 0.0 110.305 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.19 -14.84 63.29 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.372 -0.83 . . . . 0.0 110.587 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -108.55 -3.73 32.59 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.727 HD12 ' HA ' ' A' ' 88' ' ' HIS . 19.3 mt -67.49 -54.98 15.97 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.046 -1.267 . . . . 0.0 110.375 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.542 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo . . . . . 0 C--N 1.313 -1.329 0 O-C-N 123.319 1.168 . . . . 0.0 110.65 179.877 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.074 0.464 . . . . 0.0 110.289 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 40.3 tttp -64.78 -43.93 91.65 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 110.291 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.63 85.45 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -62.53 -46.32 88.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.331 -0.856 . . . . 0.0 109.747 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -25.48 67.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.775 . . . . 0.0 110.125 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.5 t -58.77 -59.28 5.67 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.805 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -60.29 -38.49 83.77 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.383 -0.823 . . . . 0.0 109.82 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 28.9 mt -63.24 -29.33 70.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.723 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -99.66 14.74 29.05 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.541 -0.725 . . . . 0.0 110.257 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.656 ' CD2' HD21 ' A' ' 87' ' ' LEU . 60.2 t60 -97.83 25.49 5.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.243 -0.91 . . . . 0.0 110.171 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 ttp-105 -72.31 -50.05 29.89 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.426 -0.796 . . . . 0.0 110.104 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -63.13 -27.05 69.12 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.29 -45.48 12.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.321 -0.862 . . . . 0.0 110.322 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 16' ' ' LEU . 2.8 tm? -64.32 -48.4 75.76 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.277 -0.889 . . . . 0.0 109.735 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -64.58 -33.27 75.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.369 -0.832 . . . . 0.0 110.125 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -82.93 -27.32 30.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.344 -0.848 . . . . 0.0 110.123 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.669 ' HB3' HD11 ' A' ' 83' ' ' LEU . 57.2 m-20 -84.2 -63.65 1.3 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -0.831 . . . . 0.0 110.145 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.666 HD13 HG13 ' A' ' 25' ' ' ILE . 27.3 mt -136.11 109.78 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.605 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.564 ' O ' ' C ' ' A' ' 22' ' ' THR . 6.6 mttt -62.15 142.69 57.48 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.353 -0.842 . . . . 0.0 109.241 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.772 HG21 ' HG2' ' A' ' 52' ' ' ARG . 11.7 p -23.62 97.64 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.677 0.751 . . . . 0.0 111.29 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 17.9 t -141.98 -176.28 4.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.665 -0.647 . . . . 0.0 110.316 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 16.4 t80 -33.42 -38.05 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.899 -0.5 . . . . 0.0 111.842 -179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.666 HG13 HD13 ' A' ' 20' ' ' ILE . 43.3 mm -58.87 -60.17 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.024 -1.047 . . . . 0.0 109.948 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.587 ' SD ' HD11 ' A' ' 60' ' ' ILE . 7.9 mmt -75.35 -28.04 59.43 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.324 -0.86 . . . . 0.0 110.233 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -74.78 -60.46 2.27 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.324 -0.86 . . . . 0.0 110.51 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -58.35 -25.78 62.38 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.386 -0.821 . . . . 0.0 110.624 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 ttt -70.6 -49.56 46.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.31 -0.869 . . . . 0.0 110.389 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.828 HD11 HD11 ' A' ' 56' ' ' LEU . 69.2 mt -60.01 -31.24 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.304 -0.872 . . . . 0.0 110.152 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 24.7 m -77.91 -14.98 59.36 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.434 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.07 -25.44 45.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.219 -0.926 . . . . 0.0 110.468 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.16 -11.48 3.85 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.538 ' CB ' HD12 ' A' ' 35' ' ' LEU . 23.1 m-85 -58.43 -58.63 7.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.125 -1.22 . . . . 0.0 110.308 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HB2' HG23 ' A' ' 30' ' ' ILE . 5.3 mp -116.04 163.3 16.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.361 -0.837 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -59.74 148.16 35.23 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.378 -0.826 . . . . 0.0 110.41 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 71.9 mt -69.75 -20.6 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.431 -0.793 . . . . 0.0 110.239 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -58.02 -27.35 63.46 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.306 -0.871 . . . . 0.0 110.28 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -67.14 -33.77 76.14 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 110.128 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -59.81 -37.5 79.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.361 -0.837 . . . . 0.0 110.206 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -68.68 -30.22 68.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.347 -0.846 . . . . 0.0 110.101 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -76.42 -57.86 3.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.388 -0.82 . . . . 0.0 110.048 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 66.8 t -48.99 -33.92 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.409 -0.807 . . . . 0.0 110.647 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -48.83 -40.93 31.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.456 -0.777 . . . . 0.0 111.312 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -145.22 18.59 1.56 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.117 -0.989 . . . . 0.0 111.178 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.626 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -81.1 -48.49 1.07 Allowed Pre-proline 0 N--CA 1.493 1.698 0 O-C-N 121.021 -1.049 . . . . 0.0 110.71 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.626 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.7 Cg_endo -77.0 170.15 20.32 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 O-C-N 123.182 1.096 . . . . 0.0 110.291 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -134.16 -46.52 0.77 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.321 -0.862 . . . . 0.0 110.135 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -90.14 -155.34 0.37 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.09 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -76.38 -3.28 36.12 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.254 -0.904 . . . . 0.0 110.674 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -59.91 -17.56 38.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.129 -0.982 . . . . 0.0 110.553 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.772 ' HG2' HG21 ' A' ' 22' ' ' THR . 69.2 ttt180 -51.55 -43.51 62.38 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.29 -0.881 . . . . 0.0 110.621 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.23 -7.69 57.62 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.277 -0.89 . . . . 0.0 110.599 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.02 -45.01 12.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.07 -1.019 . . . . 0.0 110.021 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.0 tpp -76.44 -33.39 58.76 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.38 -0.825 . . . . 0.0 109.912 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.828 HD11 HD11 ' A' ' 30' ' ' ILE . 1.1 tm? -61.17 -44.07 97.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.445 -0.784 . . . . 0.0 109.878 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.551 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -64.17 -45.89 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.388 -0.82 . . . . 0.0 109.73 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.8 mttp -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.298 -0.876 . . . . 0.0 109.855 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.8 mmt -59.84 -35.37 74.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.301 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.587 HD11 ' SD ' ' A' ' 26' ' ' MET . 96.7 mt -59.87 -52.77 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.401 -0.812 . . . . 0.0 110.121 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.28 -36.23 58.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.334 -0.854 . . . . 0.0 110.705 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -25.5 59.45 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.247 -0.908 . . . . 0.0 110.606 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -84.98 -64.94 1.07 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.87 165.22 34.7 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.266 -0.896 . . . . 0.0 110.226 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -85.13 -22.09 28.99 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.481 -0.762 . . . . 0.0 110.318 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -56.48 -32.79 65.35 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.403 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 21.7 t -73.14 -32.44 64.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.381 -0.824 . . . . 0.0 110.154 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.805 ' CE1' HD23 ' A' ' 9' ' ' LEU . 9.3 t80 -63.55 -46.46 85.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.02 -43.91 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.019 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -62.53 -36.37 82.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.363 -0.836 . . . . 0.0 110.111 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.426 ' CE1' HD11 ' A' ' 75' ' ' LEU . 5.9 t80 -53.58 -36.85 62.37 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.327 -0.858 . . . . 0.0 109.693 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.619 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.7 t80 -63.68 -43.27 97.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.436 -0.79 . . . . 0.0 109.827 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -76.56 -27.45 55.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.391 -0.818 . . . . 0.0 110.375 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.66 -51.49 69.15 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.287 -0.883 . . . . 0.0 110.26 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.631 HD21 ' CG2' ' A' ' 25' ' ' ILE . 68.3 mt -65.7 -38.78 90.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.422 -0.799 . . . . 0.0 110.239 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.619 HD11 ' CE1' ' A' ' 72' ' ' TYR . 58.6 mt -67.01 -14.99 63.44 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.347 -0.845 . . . . 0.0 110.482 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -56.94 -25.08 57.05 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.219 -0.925 . . . . 0.0 110.479 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.68 -75.01 0.61 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.314 -0.866 . . . . 0.0 110.375 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.71 60.43 0.15 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -114.36 16.32 17.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -1.04 . . . . 0.0 110.504 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -44.84 -30.05 0.91 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.39 -0.818 . . . . 0.0 110.781 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -67.84 -60.24 2.67 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.319 -0.863 . . . . 0.0 109.732 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 83' ' ' LEU . 5.2 tt -69.77 -37.47 76.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.371 -0.831 . . . . 0.0 109.892 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.471 ' CB ' HD21 ' A' ' 76' ' ' LEU . . . -62.09 -29.58 70.42 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.378 -0.826 . . . . 0.0 110.039 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.15 71.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.431 -0.793 . . . . 0.0 110.014 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.62 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -59.16 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.33 -0.857 . . . . 0.0 109.656 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.656 HD21 ' CD2' ' A' ' 12' ' ' HIS . 1.1 mt -72.61 -37.96 67.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.39 -0.819 . . . . 0.0 110.176 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.451 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 21.6 t-160 -60.73 -51.03 71.08 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.407 -0.808 . . . . 0.0 110.258 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.55 -20.01 52.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.325 -0.859 . . . . 0.0 110.326 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.51 2.13 70.13 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.649 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 8.6 mm -76.87 -57.94 1.12 Allowed Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.027 -1.278 . . . . 0.0 110.142 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.649 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.5 Cg_endo . . . . . 0 C--N 1.314 -1.256 0 O-C-N 123.207 1.109 . . . . 0.0 110.434 179.597 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.168 0.508 . . . . 0.0 110.309 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 ttmm -51.92 -33.61 38.0 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.291 -0.881 . . . . 0.0 110.71 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . 0.403 ' HA ' ' HA ' ' A' ' 91' ' ' ILE . . . -67.63 -36.33 80.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.227 -0.92 . . . . 0.0 110.139 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.702 ' HG3' HD12 ' A' ' 61' ' ' LEU . 24.1 ttt180 -69.83 -30.34 67.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.399 -0.813 . . . . 0.0 109.969 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 0.504 ' HA ' HD12 ' A' ' 10' ' ' LEU . 92.6 m-20 -73.56 -28.92 62.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.394 -0.816 . . . . 0.0 110.172 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -62.56 -51.35 67.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 110.091 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.803 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.8 tm? -60.36 -34.64 74.15 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.344 -0.847 . . . . 0.0 109.843 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 7' ' ' ASN . 53.4 mt -62.6 -30.21 71.17 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.357 -0.839 . . . . 0.0 109.958 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -91.58 13.16 18.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.365 -0.834 . . . . 0.0 110.457 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CG ' HD21 ' A' ' 87' ' ' LEU . 42.7 t60 -96.02 22.34 7.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.283 -0.886 . . . . 0.0 110.2 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -75.35 -57.54 3.83 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.259 -0.901 . . . . 0.0 110.452 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.19 -35.12 73.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.375 -0.828 . . . . 0.0 110.49 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.49 -49.7 21.15 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.848 . . . . 0.0 110.166 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.663 HD13 ' CG1' ' A' ' 57' ' ' ILE . 7.8 tt -62.09 -32.44 72.99 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.404 -0.81 . . . . 0.0 110.255 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.01 -52.06 65.54 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.425 -0.797 . . . . 0.0 110.384 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -85.07 -25.16 27.75 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.336 -0.853 . . . . 0.0 110.48 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.612 ' HB3' HD11 ' A' ' 83' ' ' LEU . 78.9 m-20 -85.35 -65.39 1.02 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.238 -0.914 . . . . 0.0 110.773 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.9 mm -117.09 109.63 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.228 -0.92 . . . . 0.0 110.599 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.552 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.0 mttt -96.93 141.68 29.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.461 -0.774 . . . . 0.0 109.156 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.775 HG22 HD22 ' A' ' 56' ' ' LEU . 75.8 p -24.39 97.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.681 -0.637 . . . . 0.0 111.202 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 24' ' ' TYR . 41.8 t -156.78 -176.72 6.13 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.603 -0.685 . . . . 0.0 110.357 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.441 ' C ' ' O ' ' A' ' 23' ' ' SER . 14.8 t80 -33.63 -44.5 0.15 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.875 -0.515 . . . . 0.0 111.775 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.57 -52.59 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 120.963 -1.086 . . . . 0.0 109.893 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 0.521 ' HB3' HD21 ' A' ' 56' ' ' LEU . 6.9 mmt -75.38 -47.13 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.454 -0.779 . . . . 0.0 110.306 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.42 -62.17 2.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.421 -0.8 . . . . 0.0 110.793 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -53.01 -36.93 61.04 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.219 -0.926 . . . . 0.0 110.84 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 0.435 ' HG2' ' CE2' ' A' ' 34' ' ' PHE . 20.9 ttp -66.61 -42.82 86.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.278 -0.889 . . . . 0.0 110.342 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.4 HG13 ' CE ' ' A' ' 29' ' ' MET . 67.5 mt -72.47 -47.31 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.288 -0.882 . . . . 0.0 110.183 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.4 m -63.04 -18.61 63.53 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.283 -0.886 . . . . 0.0 110.48 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.31 -20.04 39.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.193 -0.942 . . . . 0.0 110.535 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.75 -5.05 5.46 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.435 ' CE2' ' HG2' ' A' ' 29' ' ' MET . 7.4 m-30 -55.82 -54.89 39.04 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.136 -1.214 . . . . 0.0 110.395 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.64 HD21 ' HB2' ' A' ' 63' ' ' LYS . 1.1 mp -129.07 165.11 21.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.365 -0.835 . . . . 0.0 110.077 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.9 p -56.85 145.17 30.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.378 -0.826 . . . . 0.0 110.492 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.4 mt -61.76 -23.89 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.432 -0.792 . . . . 0.0 110.28 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.9 m -59.36 -26.3 64.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.265 -0.897 . . . . 0.0 110.371 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.02 -46.64 83.56 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.273 -0.892 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.06 -32.43 73.8 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.398 -0.814 . . . . 0.0 110.157 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -64.89 -27.53 68.92 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt -84.85 -59.68 2.28 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.389 -0.82 . . . . 0.0 110.33 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . 1.02 HG11 HD13 ' A' ' 56' ' ' LEU . 58.4 t -48.14 -33.89 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.432 -0.793 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -47.82 -40.78 22.14 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.409 -0.807 . . . . 0.0 111.14 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.2 18.27 1.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.868 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.612 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.3 tm-20 -81.98 -48.16 0.95 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.108 -0.995 . . . . 0.0 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.612 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.4 Cg_endo -76.05 169.94 21.1 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.186 1.098 . . . . 0.0 110.359 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.5 m -128.6 -40.09 1.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 110.345 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -154.35 0.51 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.15 -12.59 41.31 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.25 -0.906 . . . . 0.0 110.83 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -51.75 -24.52 5.98 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.114 -0.991 . . . . 0.0 110.686 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.447 ' CD ' HG21 ' A' ' 22' ' ' THR . 29.4 ttm180 -55.27 -40.13 70.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.26 -0.9 . . . . 0.0 110.322 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.47 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -81.08 -11.54 59.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -0.874 . . . . 0.0 110.469 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.43 -47.76 9.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.988 . . . . 0.0 110.261 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.5 ttt -71.81 -37.85 70.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.84 . . . . 0.0 110.378 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 1.02 HD13 HG11 ' A' ' 43' ' ' VAL . 13.0 tp -60.36 -46.34 90.29 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.257 -0.902 . . . . 0.0 110.306 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.663 ' CG1' HD13 ' A' ' 16' ' ' LEU . 1.3 mp -72.51 -39.12 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.837 . . . . 0.0 109.987 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -64.49 -37.29 87.02 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.712 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.36 -31.35 70.24 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 109.939 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' A' ' 57' ' ' ILE . 97.1 mt -60.77 -54.74 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.407 -0.808 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.702 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.93 -27.69 64.97 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 110.601 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -67.68 -29.09 68.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.244 -0.91 . . . . 0.0 110.342 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.64 ' HB2' HD21 ' A' ' 35' ' ' LEU . 1.3 tmtt? -72.74 -64.97 0.85 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.257 -0.902 . . . . 0.0 110.235 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -160.09 166.7 29.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.391 -0.818 . . . . 0.0 110.182 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -81.05 -25.5 37.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.442 -0.786 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -62.27 -34.01 75.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.13 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -59.65 -37.93 80.06 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.376 -0.827 . . . . 0.0 110.012 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.803 ' CE1' HD23 ' A' ' 9' ' ' LEU . 10.4 t80 -66.39 -34.3 77.65 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 109.84 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.6 t -72.69 -40.46 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.0 110.05 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -67.06 -43.45 82.66 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.436 -0.79 . . . . 0.0 110.022 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.726 ' CE1' HD11 ' A' ' 75' ' ' LEU . 1.1 t80 -55.15 -29.89 58.72 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.38 -0.825 . . . . 0.0 109.789 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.678 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 26.9 t80 -67.57 -39.64 84.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.355 -0.841 . . . . 0.0 109.939 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -76.51 -34.52 58.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.414 -0.804 . . . . 0.0 110.308 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.8 -31.98 70.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.336 -0.853 . . . . 0.0 110.33 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.726 HD11 ' CE1' ' A' ' 71' ' ' PHE . 36.9 mt -82.88 -37.35 24.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.313 -0.867 . . . . 0.0 110.279 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.678 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 20.7 mt -70.13 -14.88 62.85 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.388 -0.82 . . . . 0.0 110.477 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -70.49 -23.1 62.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.098 -1.001 . . . . 0.0 110.742 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -106.26 -75.49 0.63 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.21 -0.931 . . . . 0.0 110.559 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.31 35.98 0.1 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -100.46 16.04 25.91 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.502 -0.999 . . . . 0.0 110.51 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 45.4 tttt -46.75 -31.78 3.19 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.352 -0.843 . . . . 0.0 110.711 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -67.07 -51.57 52.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.87 . . . . 0.0 109.694 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.612 HD11 ' HB3' ' A' ' 19' ' ' ASP . 4.9 tt -71.14 -48.79 49.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 109.99 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -57.9 -34.92 70.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.417 -0.802 . . . . 0.0 110.312 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.75 -36.02 77.85 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.364 -0.835 . . . . 0.0 110.029 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 0.421 HD23 ' C ' ' A' ' 86' ' ' LEU . 10.0 tt -62.43 -36.5 82.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.422 -0.799 . . . . 0.0 110.288 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.45 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.1 mt -80.83 -29.87 35.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.367 -0.833 . . . . 0.0 110.351 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.873 ' HA ' HD12 ' A' ' 91' ' ' ILE . 57.1 t-80 -75.31 -55.21 5.93 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.393 -0.817 . . . . 0.0 110.494 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.16 -19.13 52.42 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.289 -0.882 . . . . 0.0 110.588 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.86 -22.82 48.2 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.873 HD12 ' HA ' ' A' ' 88' ' ' HIS . 16.7 mt -56.94 -53.76 61.6 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.269 -1.136 . . . . 0.0 110.684 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.577 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 46.1 Cg_endo . . . . . 0 C--N 1.312 -1.353 0 O-C-N 123.289 1.152 . . . . 0.0 110.735 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.094 0.473 . . . . 0.0 110.116 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -49.44 -37.05 24.34 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.39 -0.819 . . . . 0.0 110.707 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.15 99.34 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.355 -0.84 . . . . 0.0 110.111 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . 0.511 ' NH1' HD11 ' A' ' 10' ' ' LEU . 5.8 ttp85 -65.78 -32.88 74.66 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.348 -0.845 . . . . 0.0 110.126 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -75.4 -25.0 57.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.321 -0.862 . . . . 0.0 110.143 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -62.23 -50.41 71.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.271 -0.893 . . . . 0.0 110.123 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.954 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -64.81 -36.42 84.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 ' NH1' ' A' ' 6' ' ' ARG . 50.8 mt -68.73 -31.61 70.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.428 -0.795 . . . . 0.0 109.909 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -96.84 27.7 3.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.415 -0.803 . . . . 0.0 110.01 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.451 ' CD2' ' HB2' ' A' ' 16' ' ' LEU . 60.5 t60 -112.07 36.57 3.29 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.803 . . . . 0.0 110.079 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.424 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 35.7 ttp180 -75.07 -64.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.497 -0.752 . . . . 0.0 110.297 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.83 -27.64 69.02 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.387 -0.821 . . . . 0.0 110.221 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.86 -50.24 74.24 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 110.317 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 19' ' ' ASP . 0.7 OUTLIER -75.09 -26.25 59.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 110.533 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.25 -46.06 54.57 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.264 -0.898 . . . . 0.0 110.64 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -85.25 -22.37 28.66 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.421 -0.799 . . . . 0.0 110.531 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . 69.5 m-20 -85.02 -64.99 1.06 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.701 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.83 HD13 HG13 ' A' ' 25' ' ' ILE . 43.4 mt -131.4 164.87 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.154 -0.966 . . . . 0.0 111.045 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.581 ' O ' ' C ' ' A' ' 22' ' ' THR . 15.6 mmtp -131.84 142.86 49.83 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.581 ' C ' ' O ' ' A' ' 21' ' ' LYS . 71.9 p -23.15 96.03 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 121.641 0.734 . . . . 0.0 110.993 -179.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 0.456 ' O ' ' C ' ' A' ' 24' ' ' TYR . 65.2 p -155.84 -175.5 5.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.69 -0.631 . . . . 0.0 110.089 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 0.456 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.8 t80 -32.59 -40.68 0.05 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.751 -0.593 . . . . 0.0 111.805 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.83 HG13 HD13 ' A' ' 20' ' ' ILE . 42.5 mm -55.56 -60.5 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.94 -1.1 . . . . 0.0 109.541 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.53 -34.96 60.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.404 -0.81 . . . . 0.0 110.092 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -67.32 -61.33 1.97 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.392 -0.818 . . . . 0.0 110.375 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -53.02 -24.98 10.86 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.274 -0.891 . . . . 0.0 110.456 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.1 mmt -78.16 -34.37 49.74 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.341 -0.849 . . . . 0.0 110.226 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.996 HD11 HD21 ' A' ' 56' ' ' LEU . 73.1 mt -81.96 -43.5 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -66.8 -19.82 65.82 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.36 -0.837 . . . . 0.0 110.485 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.69 -20.29 47.22 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.262 -0.899 . . . . 0.0 110.436 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.96 -6.25 4.75 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 0.422 ' HB2' ' HA ' ' A' ' 30' ' ' ILE . 8.7 m-30 -53.68 -58.41 7.3 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.102 -1.234 . . . . 0.0 110.454 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 63' ' ' LYS . 1.2 mt -132.03 165.06 24.84 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.303 -0.873 . . . . 0.0 110.292 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.4 p -55.48 144.31 26.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.375 -0.828 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.8 mt -74.37 -25.33 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 110.116 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -59.26 -46.1 89.43 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.378 -0.826 . . . . 0.0 110.364 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.72 -32.78 74.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.342 -0.849 . . . . 0.0 110.119 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -63.27 -45.71 90.23 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.816 . . . . 0.0 110.049 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.76 -29.94 60.45 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.375 -0.828 . . . . 0.0 110.114 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 26.0 ttmt -62.86 -54.72 34.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.428 -0.795 . . . . 0.0 109.946 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.2 t -44.7 -33.73 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.572 -0.705 . . . . 0.0 110.557 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -49.24 -33.76 13.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.552 -0.717 . . . . 0.0 111.291 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -145.35 14.09 1.42 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.052 -1.03 . . . . 0.0 111.628 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.5 tm-20 -82.05 -48.61 0.92 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 120.878 -1.139 . . . . 0.0 110.959 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.9 Cg_endo -77.97 160.19 30.46 Favored 'Trans proline' 0 C--N 1.314 -1.277 0 O-C-N 123.376 1.198 . . . . 0.0 110.709 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 49.3 m -126.87 -32.24 2.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.49 -0.756 . . . . 0.0 110.282 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 0.414 ' CD ' ' H ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -106.05 -164.07 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.32 -0.863 . . . . 0.0 110.202 179.603 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -19.06 21.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.327 -0.858 . . . . 0.0 110.628 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -52.49 -21.54 3.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.225 -0.922 . . . . 0.0 110.666 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -50.36 -65.27 0.59 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.297 -0.877 . . . . 0.0 110.649 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.601 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -66.08 -47.52 74.0 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.385 -0.822 . . . . 0.0 109.913 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.424 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -52.17 -33.56 41.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.354 -0.841 . . . . 0.0 110.394 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.3 ttt -81.31 -26.49 35.63 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.109 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.996 HD21 HD11 ' A' ' 30' ' ' ILE . 5.4 tt -73.05 -50.81 20.84 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.338 -0.851 . . . . 0.0 110.171 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.601 HD12 ' O ' ' A' ' 53' ' ' ALA . 3.1 mp -62.56 -37.57 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.399 -0.813 . . . . 0.0 109.913 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -37.35 84.09 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.268 -0.895 . . . . 0.0 109.634 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 28.5 mmm -60.94 -30.18 70.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.825 . . . . 0.0 110.102 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 57' ' ' ILE . 93.2 mt -62.32 -46.26 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.407 -0.808 . . . . 0.0 109.917 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.426 HD21 ' HG ' ' A' ' 9' ' ' LEU . 1.9 mm? -73.52 -28.64 62.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.438 -0.789 . . . . 0.0 110.547 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -40.16 94.63 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.465 ' HB2' HD21 ' A' ' 35' ' ' LEU . 11.5 tttm -61.38 -65.47 0.69 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.301 -0.874 . . . . 0.0 110.315 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.42 170.03 21.83 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.373 -0.829 . . . . 0.0 110.293 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -80.02 -30.12 39.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.383 -0.823 . . . . 0.0 110.142 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -62.38 -27.73 69.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.399 -0.813 . . . . 0.0 110.184 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . 0.403 ' OG ' ' CD2' ' A' ' 34' ' ' PHE . 2.9 t -62.85 -39.47 94.5 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.394 -0.816 . . . . 0.0 110.085 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 0.954 ' CE1' HD23 ' A' ' 9' ' ' LEU . 5.5 t80 -62.08 -39.61 93.01 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.418 -0.801 . . . . 0.0 110.015 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 63.5 t -64.9 -41.77 93.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.316 -0.865 . . . . 0.0 109.964 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 38.4 t -63.06 -37.35 86.85 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.388 -0.82 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 0.538 ' CE1' HD11 ' A' ' 75' ' ' LEU . 6.5 t80 -54.18 -35.96 62.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.371 -0.83 . . . . 0.0 109.767 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.691 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.4 t80 -63.59 -45.82 88.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.419 -0.8 . . . . 0.0 110.078 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -28.45 65.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.256 -0.903 . . . . 0.0 110.296 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.88 -55.64 30.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.3 -0.875 . . . . 0.0 110.419 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.538 HD11 ' CE1' ' A' ' 71' ' ' PHE . 11.9 mt -60.72 -35.96 77.63 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.374 -0.829 . . . . 0.0 110.39 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.691 HD11 ' CE1' ' A' ' 72' ' ' TYR . 30.3 mt -71.71 -14.98 62.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.446 -0.784 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -59.71 -33.06 71.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.194 -0.941 . . . . 0.0 110.656 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -105.52 -75.37 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -0.918 . . . . 0.0 110.392 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.95 35.22 0.1 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -95.68 16.32 17.65 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.36 -1.083 . . . . 0.0 110.311 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -45.0 -29.45 0.84 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.412 -0.805 . . . . 0.0 110.863 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.55 -50.17 72.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.269 -0.894 . . . . 0.0 109.757 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.656 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -74.56 -41.79 59.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.38 -0.825 . . . . 0.0 109.587 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.84 -32.47 73.69 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 109.999 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.98 -34.61 78.49 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.91 -46.73 87.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.301 -0.874 . . . . 0.0 110.455 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.8 mp -74.86 -47.41 30.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.336 -0.853 . . . . 0.0 110.332 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 67.8 t60 -59.85 -44.12 94.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.38 -0.825 . . . . 0.0 110.516 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -58.23 -20.64 43.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.329 -0.857 . . . . 0.0 110.534 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -107.08 14.15 40.52 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.63 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 7.8 mm -74.08 -57.12 2.42 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.259 . . . . 0.0 109.984 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.63 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo . . . . . 0 C--N 1.314 -1.286 0 O-C-N 123.347 1.182 . . . . 0.0 110.476 179.622 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.203 -1.353 0 CA-C-O 121.176 0.512 . . . . 0.77000000000000002 110.335 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 1.248 ' CE ' ' CG ' ' A' ' 4' ' ' LYS . 10.3 tttt -57.31 -37.56 72.67 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.424 -0.797 . . . . 2.0600000000000001 110.491 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.48 -39.39 93.29 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.155 -0.966 . . . . 0.37 110.154 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -66.43 -33.45 75.74 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.29 -0.881 . . . . 2.5299999999999998 110.11 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ASN . . . . . 1.038 ' ND2' ' CB ' ' A' ' 7' ' ' ASN . 3.3 m-20 -72.82 -28.64 62.67 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.395 -0.816 . . . . 1.21 110.182 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 t -61.13 -55.13 36.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.418 -0.801 . . . . 0.64000000000000001 110.249 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.772 HD13 ' O ' ' A' ' 9' ' ' LEU . 1.2 tm? -59.24 -36.03 74.74 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.029 -1.044 . . . . 0.35999999999999999 110.034 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 66.5 mt -71.01 -28.72 64.62 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.42 -0.8 . . . . 0.68000000000000005 110.242 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 1.178 ' NE2' ' CG ' ' A' ' 11' ' ' GLN . 55.1 tt0 -100.15 20.06 15.28 Favored 'General case' 0 C--O 1.171 -3.037 0 CA-C-O 121.526 0.679 . . . . 2.1400000000000001 110.53 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' HIS . . . . . 0.938 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 3.6 t-160 -112.83 30.88 6.8 Favored 'General case' 0 C--N 1.262 -3.2 0 O-C-N 120.166 -1.584 . . . . 2.27 111.541 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . 0.706 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 49.2 ttp180 -72.97 -43.92 61.69 Favored 'General case' 0 C--N 1.274 -2.679 0 O-C-N 121.292 -0.88 . . . . 2.1600000000000001 110.929 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . 1.036 ' OE1' ' CG ' ' A' ' 14' ' ' GLU . 69.6 tt0 -62.25 -33.91 75.51 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.107 -0.995 . . . . 1.3100000000000001 110.455 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ALA . . . . . 0.938 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -78.43 -42.9 28.73 Favored 'General case' 0 C--O 1.195 -1.798 0 O-C-N 121.231 -0.918 . . . . 0.63 110.59 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' LEU . . . . . 1.306 ' CD2' ' CB ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.19 -38.93 86.22 Favored 'General case' 0 C--N 1.29 -1.995 0 O-C-N 121.1 -1.0 . . . . 1.49 110.152 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 1.058 ' OE1' ' CG ' ' A' ' 17' ' ' GLU . 60.2 tt0 -60.22 -41.99 94.21 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.466 -0.771 . . . . 1.73 110.638 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -78.11 -32.62 50.6 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.173 -0.954 . . . . 1.8400000000000001 110.575 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . 1.012 ' OD1' ' CB ' ' A' ' 19' ' ' ASP . 65.9 m-20 -82.75 -63.7 1.32 Allowed 'General case' 0 C--N 1.272 -2.768 0 O-C-N 120.337 -1.477 . . . . 1.3799999999999999 111.564 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ILE . . . . . 0.573 HD12 HG21 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -119.39 136.45 56.52 Favored 'Isoleucine or valine' 1 C--O 1.102 -6.689 0 O-C-N 120.73 -1.231 . . . . 1.04 112.225 -179.883 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.68 ' O ' ' HB2' ' A' ' 23' ' ' SER . 88.5 mttt -112.85 141.99 46.03 Favored 'General case' 1 C--N 1.224 -4.851 0 O-C-N 116.772 -3.705 . . . . 1.95 109.125 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . 0.625 HG21 ' HG2' ' A' ' 52' ' ' ARG . 75.7 p -24.2 97.41 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.505 0.669 . . . . 0.48999999999999999 111.212 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' SER . . . . . 1.073 ' OG ' ' CB ' ' A' ' 23' ' ' SER . 0.4 OUTLIER -156.33 -176.21 5.84 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.409 -0.807 . . . . 1.1100000000000001 110.233 -178.648 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TYR . . . . . 1.392 ' CZ ' ' CD2' ' A' ' 24' ' ' TYR . 12.8 t80 -33.23 -39.82 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.805 -0.559 . . . . 1.26 111.943 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ILE . . . . . 0.573 HG21 HD12 ' A' ' 20' ' ' ILE . 44.0 mm -55.74 -62.7 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 120.962 -1.086 . . . . 0.32000000000000001 110.079 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' MET . . . . . 1.279 ' SD ' ' CE ' ' A' ' 26' ' ' MET . 1.6 mmt -75.54 -38.03 59.59 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.313 -0.867 . . . . 1.21 110.473 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ASP . . . . . 1.044 ' OD1' ' CB ' ' A' ' 27' ' ' ASP . 5.0 t70 -61.03 -53.87 51.87 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 120.89 -1.131 . . . . 1.1799999999999999 110.705 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' HIS . . . . . 1.408 ' CG ' ' CE1' ' A' ' 28' ' ' HIS . 18.4 t-160 -57.05 -34.22 68.01 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.887 -1.133 . . . . 1.22 110.361 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' MET . . . . . 1.344 ' CE ' ' CB ' ' A' ' 29' ' ' MET . 2.8 mtt -68.51 -41.82 79.44 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 120.943 -1.098 . . . . 2.7000000000000002 110.411 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ILE . . . . . 0.597 HG23 ' HB2' ' A' ' 35' ' ' LEU . 86.1 mt -64.15 -42.9 97.02 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.169 0 O-C-N 120.91 -1.119 . . . . 0.91000000000000003 110.382 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.1 m -77.52 -18.81 56.66 Favored 'General case' 0 C--N 1.283 -2.32 0 O-C-N 120.496 -1.377 . . . . 0.58999999999999997 110.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASP . . . . . 1.097 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 4.9 t70 -58.9 -22.85 60.28 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.087 -1.008 . . . . 1.3200000000000001 110.453 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.82 -12.49 3.4 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.109 -1.196 . . . . 0.39000000000000001 110.109 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PHE . . . . . 1.387 ' CZ ' ' CD1' ' A' ' 34' ' ' PHE . 12.7 m-30 -59.42 -61.51 2.57 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.851 -1.382 . . . . 1.29 110.37 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' LEU . . . . . 1.291 ' CD1' ' CB ' ' A' ' 35' ' ' LEU . 5.6 mp -119.39 162.93 17.98 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.214 -0.929 . . . . 1.3799999999999999 110.558 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.9 p -61.52 157.7 16.6 Favored 'General case' 0 C--O 1.199 -1.603 0 O-C-N 121.201 -0.937 . . . . 0.59999999999999998 110.344 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.3 mt -75.97 -22.36 15.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.2 0 O-C-N 120.807 -1.183 . . . . 1.21 110.459 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 m -59.17 -30.05 67.9 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.308 -0.87 . . . . 0.68999999999999995 110.456 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -67.07 -31.9 72.71 Favored 'General case' 0 C--N 1.283 -2.308 0 O-C-N 121.176 -0.952 . . . . 1.78 110.712 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 1.163 ' CD ' ' CB ' ' A' ' 40' ' ' GLU . 7.4 tt0 -65.89 -38.8 89.71 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.956 0.884 . . . . 2.3199999999999998 110.406 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' GLU . . . . . 1.127 ' OE2' ' CG ' ' A' ' 41' ' ' GLU . 32.5 tt0 -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.277 -2.576 0 O-C-N 120.946 -1.096 . . . . 1.75 110.692 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 10.5 ttmt -75.99 -56.95 4.18 Favored 'General case' 0 C--N 1.283 -2.311 0 O-C-N 120.903 -1.123 . . . . 1.52 110.407 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.0 t -50.12 -33.78 9.99 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.495 -0.753 . . . . 0.51000000000000001 110.638 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -47.38 -40.4 17.53 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.564 -0.71 . . . . 2.8199999999999998 111.613 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 1.202 ' OD1' ' CB ' ' A' ' 45' ' ' ASN . 2.4 t30 -143.72 16.59 1.8 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.026 -1.046 . . . . 1.3500000000000001 111.225 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . 1.273 ' CD ' ' CB ' ' A' ' 46' ' ' GLU . 1.4 tt0 -80.24 -50.88 1.11 Allowed Pre-proline 0 C--N 1.299 -1.606 0 O-C-N 120.867 -1.145 . . . . 2.52 110.893 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.746 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.4 Cg_endo -75.81 168.81 23.52 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 O-C-N 123.127 1.067 . . . . 0.57999999999999996 110.465 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.5 m -135.94 -42.21 0.66 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.47 -0.769 . . . . 0.84999999999999998 110.517 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' GLN . . . . . 1.514 ' NE2' ' CG ' ' A' ' 49' ' ' GLN . 12.6 mm-40 -95.37 -159.05 0.69 Allowed 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.915 -1.116 . . . . 2.0099999999999998 110.063 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -65.74 -12.69 55.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.26 -0.9 . . . . 2.6099999999999999 110.952 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' GLN . . . . . 1.041 ' OE1' ' CG ' ' A' ' 51' ' ' GLN . 56.5 tt0 -56.36 -20.2 18.11 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.288 -0.882 . . . . 1.45 110.75 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 1.445 ' CD ' ' CZ ' ' A' ' 52' ' ' ARG . 45.5 ttt180 -51.44 -48.9 62.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.174 -0.954 . . . . 2.1099999999999999 110.752 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ALA . . . . . 0.637 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -77.3 -34.8 55.41 Favored 'General case' 1 C--O 1.147 -4.314 0 O-C-N 120.679 -1.263 . . . . 0.78000000000000003 110.318 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ALA . . . . . 0.706 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -63.15 -36.75 84.64 Favored 'General case' 1 C--N 1.241 -4.11 0 O-C-N 118.042 -2.911 . . . . 0.56999999999999995 110.666 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' MET . . . . . 1.393 ' CE ' ' CG ' ' A' ' 55' ' ' MET . 11.8 ttt -78.26 -34.54 48.97 Favored 'General case' 0 C--N 1.293 -1.858 0 O-C-N 121.194 -0.941 . . . . 1.76 110.246 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.3 tp -69.16 -41.58 77.06 Favored 'General case' 0 C--N 1.287 -2.152 0 O-C-N 120.616 -1.303 . . . . 0.82999999999999996 110.441 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.637 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -65.62 -37.37 79.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 O-C-N 121.1 -1.0 . . . . 0.59999999999999998 110.174 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -66.8 -39.91 87.93 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.044 -1.035 . . . . 1.3999999999999999 110.017 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' MET . . . . . 1.304 ' SD ' ' CE ' ' A' ' 59' ' ' MET . 5.6 mmt -58.62 -31.18 67.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.882 . . . . 1.4399999999999999 110.229 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' A' ' 57' ' ' ILE . 98.6 mt -63.59 -53.96 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.303 -0.873 . . . . 0.39000000000000001 109.938 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.459 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.0 mm? -75.24 -32.46 61.12 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.405 -0.809 . . . . 0.42999999999999999 110.672 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 1.47 ' CD ' ' NZ ' ' A' ' 62' ' ' LYS . 16.9 mmtt -61.19 -27.9 68.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.15 -0.969 . . . . 1.76 110.567 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 1.532 ' CG ' ' CE ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -73.43 -65.0 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.233 -0.917 . . . . 2.4700000000000002 110.363 -179.917 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 1.18 ' OD2' ' CB ' ' A' ' 64' ' ' ASP . 13.4 t0 -159.73 165.34 32.72 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.345 -0.847 . . . . 1.75 110.211 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ASN . . . . . 0.997 ' ND2' ' CB ' ' A' ' 65' ' ' ASN . 2.7 m-20 -80.07 -26.4 39.66 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.287 -0.883 . . . . 0.98999999999999999 110.32 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASP . . . . . 0.997 ' OD2' ' CB ' ' A' ' 66' ' ' ASP . 12.4 m-20 -61.43 -35.36 77.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.876 . . . . 1.24 110.347 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.4 t -62.59 -34.57 77.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.274 -0.891 . . . . 0.46999999999999997 110.162 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' TYR . . . . . 1.395 ' CZ ' ' CD2' ' A' ' 68' ' ' TYR . 19.3 t80 -64.33 -38.53 91.37 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.211 -0.931 . . . . 1.26 110.068 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.7 t -68.0 -39.32 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.281 -0.887 . . . . 0.32000000000000001 110.052 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -66.78 -36.53 82.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.23 -0.919 . . . . 0.27000000000000002 110.054 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' PHE . . . . . 1.426 ' CZ ' ' CD1' ' A' ' 71' ' ' PHE . 1.2 t80 -55.43 -37.43 67.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.288 -0.882 . . . . 1.24 109.886 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 1.367 ' CG ' ' CE2' ' A' ' 72' ' ' TYR . 44.8 t80 -64.41 -43.85 93.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 1.25 110.104 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASN . . . . . 1.011 ' ND2' ' CB ' ' A' ' 73' ' ' ASN . 8.9 t30 -75.44 -26.73 58.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.271 -0.893 . . . . 1.01 110.463 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.03 94.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.93 . . . . 0.32000000000000001 110.338 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' LEU . . . . . 0.449 HD11 ' CZ ' ' A' ' 71' ' ' PHE . 16.8 mt -75.26 -38.44 60.47 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.949 -1.095 . . . . 0.40000000000000002 110.274 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . 0.735 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.9 mt -67.25 -15.13 63.52 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.405 -0.809 . . . . 0.41999999999999998 110.554 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' HIS . . . . . 1.387 ' CG ' ' CE1' ' A' ' 77' ' ' HIS . 3.5 t-80 -62.32 -24.7 67.47 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 1.24 110.751 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLU . . . . . 1.447 ' OE1' ' CG ' ' A' ' 78' ' ' GLU . 28.0 mt-10 -109.74 -75.21 0.63 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.172 -0.955 . . . . 1.5900000000000001 110.414 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.89 47.77 0.15 Allowed Glycine 0 C--O 1.187 -2.791 0 N-CA-C 109.438 -1.465 . . . . 0.55000000000000004 109.438 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' TYR . . . . . 1.409 ' CG ' ' CE2' ' A' ' 80' ' ' TYR . 34.6 m-85 -106.16 16.22 25.23 Favored 'General case' 0 C--N 1.276 -2.599 0 O-C-N 120.029 -1.865 . . . . 1.3799999999999999 110.534 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . 1.423 ' CD ' ' NZ ' ' A' ' 81' ' ' LYS . 46.6 tttt -44.88 -31.59 1.3 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.424 -0.797 . . . . 1.6699999999999999 110.953 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . 1.005 ' OD1' ' CB ' ' A' ' 82' ' ' ASP . 2.7 m-20 -68.34 -51.98 38.38 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 1.26 109.9 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.413 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -72.12 -44.12 63.65 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.048 -1.033 . . . . 1.52 110.174 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.02 -35.06 74.25 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.405 -0.81 . . . . 0.46000000000000002 110.228 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -62.43 -36.0 81.02 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.306 -0.871 . . . . 0.5 110.169 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' LEU . . . . . 1.284 ' CD2' ' CB ' ' A' ' 86' ' ' LEU . 9.1 tp -60.31 -43.54 96.25 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.35 -0.844 . . . . 1.5900000000000001 110.368 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' LEU . . . . . 0.481 ' O ' HG13 ' A' ' 91' ' ' ILE . 0.9 OUTLIER -75.29 -35.44 61.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.208 -0.933 . . . . 0.56000000000000005 110.25 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' HIS . . . . . 1.431 ' CG ' ' CE1' ' A' ' 88' ' ' HIS . 22.7 t-80 -68.97 -39.25 79.57 Favored 'General case' 0 C--O 1.187 -2.226 0 O-C-N 120.93 -1.106 . . . . 1.3200000000000001 110.559 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ASP . . . . . 0.981 ' OD1' ' CB ' ' A' ' 89' ' ' ASP . 53.4 m-20 -69.67 -18.87 63.6 Favored 'General case' 0 C--N 1.278 -2.542 0 O-C-N 120.165 -1.585 . . . . 1.3200000000000001 110.908 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.63 -14.78 52.21 Favored Glycine 0 C--O 1.189 -2.681 0 C-N-CA 119.709 -1.234 . . . . 0.63 110.363 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' ILE . . . . . 0.624 HD12 ' HA ' ' A' ' 88' ' ' HIS . 33.9 mt -64.75 -54.33 36.72 Favored Pre-proline 0 C--N 1.286 -2.188 0 O-C-N 120.488 -1.596 . . . . 0.70999999999999996 110.452 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' PRO . . . . . 0.61 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.7 Cg_endo . . . . . 0 C--O 1.178 -2.525 0 O-C-N 123.158 1.083 . . . . 0.81000000000000005 110.762 179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.2 tpp . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 121.155 0.503 . . . . 0.0 110.255 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.424 ' OD1' ' N ' ' A' ' 2' ' ' ASP . 38.3 p-10 -106.65 99.53 9.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.33 -0.856 . . . . 0.0 110.413 179.949 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.49 -25.5 57.37 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.262 -0.899 . . . . 0.0 110.211 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 36.4 tttm -59.16 -35.71 74.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.324 -0.86 . . . . 0.0 110.516 -179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.552 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -56.06 -40.78 74.08 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.239 -0.913 . . . . 0.0 110.096 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.734 ' O ' HD12 ' A' ' 10' ' ' LEU . 4.0 ttp180 -62.29 -32.49 73.23 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.37 -0.831 . . . . 0.0 109.653 179.479 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 96.2 m-20 -77.88 -25.14 48.37 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.468 -0.77 . . . . 0.0 109.924 179.554 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 20.8 t -59.75 -54.19 49.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.313 -0.867 . . . . 0.0 109.935 179.703 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.958 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -62.47 -36.92 84.0 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.406 -0.809 . . . . 0.0 109.614 179.656 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.734 HD12 ' O ' ' A' ' 6' ' ' ARG . 12.3 mt -67.93 -35.3 78.18 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.31 -0.869 . . . . 0.0 109.54 179.144 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.0 tt0 -90.79 2.64 55.89 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.42 -0.8 . . . . 0.0 110.122 179.344 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.444 ' CD2' HD21 ' A' ' 87' ' ' LEU . 72.3 t60 -92.59 19.04 7.78 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.302 -0.874 . . . . 0.0 110.224 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 10.5 ttp180 -69.21 -44.29 72.39 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.287 -0.883 . . . . 0.0 110.138 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.1 tt0 -65.48 -32.61 74.32 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.395 -0.815 . . . . 0.0 110.169 -179.817 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -75.28 -42.31 55.22 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.326 -0.859 . . . . 0.0 110.169 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HG ' ' HB ' ' A' ' 20' ' ' ILE . 5.2 tt -75.93 -37.42 58.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.426 -0.796 . . . . 0.0 110.244 -179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -53.53 -41.44 66.38 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.406 -0.809 . . . . 0.0 110.469 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 14.4 tttt -85.46 -34.32 21.66 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.399 -0.813 . . . . 0.0 110.512 -179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 17.2 m-20 -85.22 -65.53 1.0 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.256 -0.903 . . . . 0.0 110.782 -179.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.477 ' HB ' ' HG ' ' A' ' 16' ' ' LEU . 11.0 mm -108.44 111.13 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.295 -0.878 . . . . 0.0 110.647 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.565 ' O ' ' C ' ' A' ' 22' ' ' THR . 4.3 mtpt -97.06 141.75 29.83 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.598 -0.689 . . . . 0.0 109.349 179.215 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.565 ' C ' ' O ' ' A' ' 21' ' ' LYS . 69.5 p -24.44 97.4 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 CA-C-O 121.455 0.645 . . . . 0.0 111.184 -179.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 27.5 t -157.36 -176.8 6.16 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.556 -0.715 . . . . 0.0 110.154 -178.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 15.9 t80 -33.54 -41.58 0.09 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.773 -0.58 . . . . 0.0 111.788 -179.724 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.44 HG13 HD12 ' A' ' 20' ' ' ILE . 44.0 mm -59.38 -50.01 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 121.053 -1.03 . . . . 0.0 110.007 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.571 ' HE1' HD11 ' A' ' 60' ' ' ILE . 0.6 OUTLIER -75.65 -37.49 59.62 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.339 -0.851 . . . . 0.0 110.439 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 24.4 t0 -72.35 -57.56 4.1 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.255 -0.903 . . . . 0.0 110.605 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -51.7 -25.22 6.87 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.313 -0.867 . . . . 0.0 110.579 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -78.6 -57.07 3.96 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.308 -0.87 . . . . 0.0 110.174 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.669 HG23 ' HB2' ' A' ' 35' ' ' LEU . 83.9 mt -57.12 -47.33 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.271 -0.893 . . . . 0.0 109.937 179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 75.0 m -66.27 -15.15 62.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.377 -0.827 . . . . 0.0 110.36 179.81 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -59.67 -28.91 67.69 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.284 -0.885 . . . . 0.0 110.395 -179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 148.32 -18.11 1.33 Allowed Glycine 0 N--CA 1.491 2.362 0 N-CA-C 110.186 -1.166 . . . . 0.0 110.186 179.973 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 21.6 m-85 -54.5 -60.7 2.99 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.122 -1.222 . . . . 0.0 110.315 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.669 ' HB2' HG23 ' A' ' 30' ' ' ILE . 1.1 mt -121.66 162.97 19.77 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.417 -0.802 . . . . 0.0 110.265 -179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 4.8 p -60.72 147.73 41.22 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.343 -0.848 . . . . 0.0 110.401 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 88.8 mt -71.37 -17.84 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.398 -0.814 . . . . 0.0 110.242 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 34.3 m -58.82 -27.88 65.49 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.326 -0.859 . . . . 0.0 110.224 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.469 ' O ' HG23 ' A' ' 43' ' ' VAL . 23.0 tt0 -68.43 -26.51 65.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.4 -0.813 . . . . 0.0 110.159 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.6 tt0 -63.32 -49.14 75.13 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.361 -0.837 . . . . 0.0 110.192 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -60.75 -27.97 68.36 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.404 -0.81 . . . . 0.0 110.182 179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 15.6 tttt -77.92 -58.58 3.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.3 -0.875 . . . . 0.0 110.064 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.695 HG11 HD13 ' A' ' 56' ' ' LEU . 65.9 t -50.91 -33.4 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.408 -0.808 . . . . 0.0 110.609 179.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 42.6 ttp85 -50.8 -42.86 58.55 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.256 -0.903 . . . . 0.0 111.34 -179.399 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 53.5 t30 -134.27 8.95 3.73 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.029 -1.044 . . . . 0.0 111.455 -179.346 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.584 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.0 tp10 -73.96 -53.6 3.96 Favored Pre-proline 0 N--CA 1.493 1.694 0 O-C-N 121.033 -1.042 . . . . 0.0 110.186 179.827 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.584 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -74.41 170.29 20.57 Favored 'Trans proline' 0 C--N 1.313 -1.325 0 O-C-N 123.388 1.204 . . . . 0.0 110.269 179.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.3 m -135.84 -38.23 0.72 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.391 -0.818 . . . . 0.0 110.436 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.9 mm100 -104.25 -157.46 0.61 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.849 . . . . 0.0 110.262 -179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -58.09 -19.83 35.1 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.344 -0.847 . . . . 0.0 110.55 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.475 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 7.4 tt0 -52.84 -23.82 7.77 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.238 -0.913 . . . . 0.0 110.56 -179.928 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.41 ' HG2' HG21 ' A' ' 22' ' ' THR . 21.1 ttp180 -52.98 -53.14 54.31 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.265 -0.897 . . . . 0.0 110.319 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.517 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -80.67 -8.65 59.71 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.323 -0.86 . . . . 0.0 110.412 179.921 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.475 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -83.85 -36.01 23.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.1 -1.0 . . . . 0.0 110.054 179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 17.4 tpp -81.21 -27.4 35.32 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.353 -0.842 . . . . 0.0 110.162 179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.695 HD13 HG11 ' A' ' 43' ' ' VAL . 14.3 tp -68.87 -38.22 79.57 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.364 -0.835 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.572 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.1 mp -74.15 -45.76 46.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.719 0 O-C-N 121.317 -0.864 . . . . 0.0 109.825 179.601 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.1 tttt -60.64 -38.44 84.79 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.256 -0.902 . . . . 0.0 109.675 179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 11.4 mmt -56.55 -36.06 68.84 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.386 -0.821 . . . . 0.0 110.113 179.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.571 HD11 ' HE1' ' A' ' 26' ' ' MET . 79.1 mt -58.02 -52.47 57.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.322 -0.861 . . . . 0.0 109.916 179.75 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.467 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.5 mm? -77.37 -29.43 53.31 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.412 -0.805 . . . . 0.0 110.706 -179.807 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 1.5 mmpt? -58.58 -25.89 63.04 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.183 -0.948 . . . . 0.0 110.592 -179.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.8 tptm -83.68 -65.57 0.99 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.246 -0.908 . . . . 0.0 110.271 -179.878 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -160.54 170.19 21.42 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.374 -0.829 . . . . 0.0 110.297 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -84.16 -20.11 32.98 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.421 -0.799 . . . . 0.0 110.271 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -60.41 -43.04 97.11 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.25 -0.906 . . . . 0.0 110.294 -179.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 28.1 t -61.32 -32.48 72.35 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.41 -0.806 . . . . 0.0 110.309 179.998 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.958 ' CE1' HD23 ' A' ' 9' ' ' LEU . 6.4 t80 -64.1 -37.18 86.51 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.384 -0.823 . . . . 0.0 110.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.2 t -72.07 -31.82 41.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.37 -0.831 . . . . 0.0 110.236 -179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.0 t -69.88 -43.57 71.55 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.294 -0.879 . . . . 0.0 110.019 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.666 ' CE1' HD11 ' A' ' 75' ' ' LEU . 1.1 t80 -53.93 -35.69 61.98 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.334 -0.854 . . . . 0.0 109.612 179.62 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.473 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 25.2 t80 -63.74 -38.5 91.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.499 -0.75 . . . . 0.0 109.858 179.586 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 30.9 t-20 -82.96 -25.52 32.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.405 -0.809 . . . . 0.0 110.158 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -66.47 -35.43 80.25 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.281 -0.887 . . . . 0.0 110.108 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.666 HD11 ' CE1' ' A' ' 71' ' ' PHE . 45.1 mt -78.36 -40.08 37.37 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.42 -0.8 . . . . 0.0 110.151 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.43 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.5 mt -65.68 -15.5 62.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.359 -0.838 . . . . 0.0 110.397 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 64.5 t-80 -65.36 -26.32 67.97 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.224 -0.922 . . . . 0.0 110.58 -179.741 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.1 mt-10 -108.01 -75.16 0.64 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.224 -0.922 . . . . 0.0 110.595 -179.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.0 62.93 0.11 Allowed Glycine 0 N--CA 1.491 2.344 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 26.1 m-85 -124.93 16.25 8.58 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.435 -1.039 . . . . 0.0 110.478 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 31.0 ttpt -46.32 -29.21 1.56 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.376 -0.827 . . . . 0.0 111.031 -179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.4 m-20 -62.13 -65.05 0.75 Allowed 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.301 -0.875 . . . . 0.0 110.077 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.43 ' O ' HD12 ' A' ' 87' ' ' LEU . 8.5 tt -66.77 -39.8 87.99 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.332 -0.855 . . . . 0.0 110.028 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.45 -39.26 60.86 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.278 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -63.08 -38.16 90.06 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.791 . . . . 0.0 109.902 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.407 HD22 ' CE1' ' A' ' 12' ' ' HIS . 8.6 tt -52.52 -46.4 66.67 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.4 -0.812 . . . . 0.0 110.568 179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.444 HD21 ' CD2' ' A' ' 12' ' ' HIS . 1.3 mp -73.06 -48.5 35.45 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.358 -0.839 . . . . 0.0 110.288 -179.907 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.614 ' HA ' HD12 ' A' ' 91' ' ' ILE . 78.1 t60 -65.37 -16.09 63.25 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.388 -0.82 . . . . 0.0 110.91 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -85.02 -14.77 46.31 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.191 -0.943 . . . . 0.0 110.747 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -111.33 -22.86 5.97 Favored Glycine 0 N--CA 1.492 2.393 0 N-CA-C 110.168 -1.173 . . . . 0.0 110.168 -179.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.624 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 54.7 mt -60.59 -52.06 75.39 Favored Pre-proline 0 N--CA 1.494 1.729 0 O-C-N 121.154 -1.204 . . . . 0.0 110.822 -179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.624 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.6 Cg_endo -72.09 -88.44 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.23 0 O-C-N 123.221 1.116 . . . . 0.0 110.581 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.506 HG13 ' O ' ' A' ' 97' ' ' SER . 58.0 t -105.87 165.84 3.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.049 -1.032 . . . . 0.0 109.958 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.463 ' N ' HG12 ' A' ' 93' ' ' VAL . 54.3 t -84.26 -68.62 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.29 -0.881 . . . . 0.0 110.04 -179.898 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 13.1 t -164.91 -52.89 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.388 -0.82 . . . . 0.0 110.091 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.5 p -93.69 -60.57 1.73 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.357 -0.84 . . . . 0.0 110.175 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 0.506 ' O ' HG13 ' A' ' 93' ' ' VAL . 42.4 m . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.062 -0.97 . . . . 0.0 110.195 -179.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.198 0.523 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.44 ' OD1' ' N ' ' A' ' 2' ' ' ASP . 37.9 p-10 -133.61 99.89 4.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.447 -0.783 . . . . 0.0 110.304 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.56 -31.34 72.51 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.272 -0.892 . . . . 0.0 110.326 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.778 ' HE3' HG23 ' A' ' 94' ' ' VAL . 49.1 tttp -63.35 -32.43 73.85 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.281 -0.887 . . . . 0.0 110.263 -179.907 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.33 -40.32 95.96 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.382 -0.824 . . . . 0.0 110.071 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.641 ' HG3' HD12 ' A' ' 61' ' ' LEU . 28.5 ttt180 -65.62 -29.66 70.27 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.367 -0.833 . . . . 0.0 110.126 179.888 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.42 ' HA ' HD12 ' A' ' 10' ' ' LEU . 28.1 m120 -74.08 -31.73 62.95 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.4 -0.813 . . . . 0.0 110.142 179.998 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 47.1 t -60.63 -51.9 67.41 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.4 -0.812 . . . . 0.0 110.294 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.821 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.6 OUTLIER -61.98 -35.26 77.97 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.368 -0.832 . . . . 0.0 110.057 179.841 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.42 HD12 ' HA ' ' A' ' 7' ' ' ASN . 67.4 mt -63.14 -34.36 77.44 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.278 -0.889 . . . . 0.0 109.89 179.706 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -97.02 24.98 5.73 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.391 -0.818 . . . . 0.0 110.066 179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.467 ' CE1' HD11 ' A' ' 87' ' ' LEU . 63.6 t60 -94.81 20.02 9.33 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.336 -0.853 . . . . 0.0 110.451 -179.982 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 70.4 ttp85 -69.29 -56.94 6.06 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.308 -0.87 . . . . 0.0 110.114 179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -65.14 -35.27 80.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.289 -0.882 . . . . 0.0 110.101 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -70.0 -46.24 65.55 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.371 -0.831 . . . . 0.0 110.298 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.474 HD22 HG13 ' A' ' 57' ' ' ILE . 1.2 tp -59.35 -39.95 84.85 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.345 -0.847 . . . . 0.0 110.183 -179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.38 -41.64 66.09 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.403 -0.811 . . . . 0.0 110.265 179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -85.06 -23.22 28.65 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.391 -0.818 . . . . 0.0 110.152 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 23.3 m-20 -84.99 -65.25 1.03 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.329 -0.857 . . . . 0.0 110.256 -179.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.768 HD13 HG13 ' A' ' 25' ' ' ILE . 14.8 mt -147.24 158.38 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.335 -0.853 . . . . 0.0 110.52 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.577 ' O ' ' C ' ' A' ' 22' ' ' THR . 5.6 mttt -114.34 141.91 47.0 Favored 'General case' 0 N--CA 1.49 1.534 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 179.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.577 ' C ' ' O ' ' A' ' 21' ' ' LYS . 58.9 p -24.23 98.75 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 CA-C-O 121.516 0.674 . . . . 0.0 110.999 -179.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.8 t -152.06 -176.22 5.57 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.568 -0.707 . . . . 0.0 110.308 -178.658 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.9 t80 -32.87 -38.94 0.04 OUTLIER 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.866 -0.521 . . . . 0.0 112.224 -179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.768 HG13 HD13 ' A' ' 20' ' ' ILE . 43.9 mm -55.89 -66.31 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 120.954 -1.091 . . . . 0.0 110.175 -179.73 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.545 ' HE3' ' CD1' ' A' ' 57' ' ' ILE . 13.9 mmm -76.53 -35.93 58.0 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.36 -0.837 . . . . 0.0 110.259 179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.681 ' HA ' HD12 ' A' ' 30' ' ' ILE . 0.4 OUTLIER -60.14 -52.68 64.3 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.432 -0.792 . . . . 0.0 110.458 -179.752 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.0 t-80 -58.49 -29.7 66.44 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.304 -0.872 . . . . 0.0 110.248 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.5 mtt -69.8 -42.5 73.63 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.271 -0.893 . . . . 0.0 110.294 179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.681 HD12 ' HA ' ' A' ' 27' ' ' ASP . 59.2 mt -55.16 -50.24 65.55 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 O-C-N 121.258 -0.901 . . . . 0.0 110.196 179.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.1 m -74.34 -14.97 60.96 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.409 -0.807 . . . . 0.0 110.301 179.768 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 6.2 t70 -57.28 -31.2 65.37 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.268 -0.895 . . . . 0.0 110.45 -179.913 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 147.47 -20.03 1.51 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.972 -1.251 . . . . 0.0 109.972 179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 20.7 m-85 -57.15 -51.65 68.44 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.163 -1.198 . . . . 0.0 110.203 -179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 1.4 mp -132.12 155.48 48.06 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.367 -0.833 . . . . 0.0 110.115 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 82.4 p -57.48 160.22 4.32 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.414 -0.804 . . . . 0.0 110.324 -179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 84.2 mt -71.19 -15.31 18.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.372 -0.83 . . . . 0.0 110.322 179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 58.3 m -56.18 -26.17 49.64 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.276 -0.89 . . . . 0.0 110.413 179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 55.0 tt0 -66.55 -34.03 77.01 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.321 -0.862 . . . . 0.0 110.219 179.97 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -68.46 -37.11 79.9 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.315 -0.865 . . . . 0.0 110.174 179.988 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.1 tt0 -65.21 -33.82 76.91 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.428 -0.795 . . . . 0.0 110.1 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -75.99 -60.56 2.27 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.354 -0.841 . . . . 0.0 110.1 179.916 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.513 HG21 HD12 ' A' ' 56' ' ' LEU . 80.4 t -48.53 -33.6 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.908 0 O-C-N 121.491 -0.755 . . . . 0.0 110.546 179.866 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 18.5 ttp180 -43.8 -48.71 8.22 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.643 -0.661 . . . . 0.0 111.403 -179.484 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -145.26 14.36 1.45 Allowed 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.118 -0.989 . . . . 0.0 111.235 -179.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.631 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.1 tp10 -80.17 -47.84 1.33 Allowed Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 121.032 -1.042 . . . . 0.0 110.962 179.928 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.631 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -75.99 170.25 20.49 Favored 'Trans proline' 0 C--N 1.316 -1.147 0 O-C-N 123.154 1.081 . . . . 0.0 110.427 -179.942 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 69.7 m -145.86 -45.41 0.21 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.362 -0.836 . . . . 0.0 110.289 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 20.9 mm100 -91.51 -166.87 1.66 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.378 -0.826 . . . . 0.0 110.305 -179.904 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -60.33 -17.78 45.29 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.359 -0.838 . . . . 0.0 110.498 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 42.6 tt0 -57.04 -18.89 15.88 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.253 -0.905 . . . . 0.0 110.556 -179.987 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 56.2 ttt180 -49.53 -60.86 2.47 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.353 -0.842 . . . . 0.0 110.579 -179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.536 ' HB2' HG23 ' A' ' 22' ' ' THR . . . -74.14 -52.57 12.13 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.297 -0.877 . . . . 0.0 110.152 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.97 -34.21 5.35 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.385 -0.822 . . . . 0.0 110.622 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.6 ttp -82.95 -25.56 32.24 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.379 -0.826 . . . . 0.0 110.104 179.687 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.513 HD12 HG21 ' A' ' 43' ' ' VAL . 6.6 tt -81.45 -35.69 30.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.345 -0.847 . . . . 0.0 110.342 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.545 ' CD1' ' HE3' ' A' ' 26' ' ' MET . 41.7 mm -64.21 -43.15 97.26 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.244 -0.91 . . . . 0.0 109.934 179.857 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 15.3 mtmt -61.06 -41.1 95.98 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.345 -0.847 . . . . 0.0 109.915 179.759 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.1 mtp -56.23 -33.33 65.29 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.303 -0.873 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.471 HD12 ' HA ' ' A' ' 57' ' ' ILE . 91.6 mt -61.19 -53.72 45.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.241 -0.912 . . . . 0.0 109.985 179.89 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.641 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.0 mm? -76.76 -30.22 56.45 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.473 -0.767 . . . . 0.0 110.506 -179.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.11 -26.62 66.37 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.302 -0.874 . . . . 0.0 110.221 -179.986 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.81 -64.99 1.03 Allowed 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.356 -0.84 . . . . 0.0 110.166 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -159.93 155.74 26.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.401 -0.812 . . . . 0.0 110.219 179.924 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 5.5 m120 -77.23 -23.9 51.3 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.357 -0.84 . . . . 0.0 110.342 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -60.08 -29.65 68.72 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.377 -0.827 . . . . 0.0 110.283 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 12.2 t -68.93 -34.91 76.14 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.304 -0.873 . . . . 0.0 110.053 179.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.821 ' CE1' HD23 ' A' ' 9' ' ' LEU . 19.9 t80 -62.45 -34.6 77.13 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.452 -0.78 . . . . 0.0 110.01 179.864 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.6 t -63.89 -40.85 90.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.41 -0.807 . . . . 0.0 110.033 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -69.42 -34.69 74.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.306 -0.871 . . . . 0.0 110.086 179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.598 ' CE1' HD11 ' A' ' 75' ' ' LEU . 32.6 t80 -53.14 -35.48 59.78 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.313 -0.867 . . . . 0.0 110.054 179.8 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.882 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 47.6 t80 -70.68 -44.6 66.69 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.333 -0.854 . . . . 0.0 110.198 179.906 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -73.26 -27.88 61.82 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.37 -0.831 . . . . 0.0 110.479 -179.781 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.57 -48.9 65.57 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.294 -0.879 . . . . 0.0 110.384 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.604 HD13 HD12 ' A' ' 83' ' ' LEU . 14.9 mt -66.46 -44.61 82.31 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.333 -0.855 . . . . 0.0 110.351 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.632 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 35.1 mt -65.32 -15.03 62.11 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.321 -0.862 . . . . 0.0 110.544 -179.965 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 7.6 t60 -63.33 -24.46 67.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.204 -0.935 . . . . 0.0 110.632 -179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 mt-10 -112.03 -75.24 0.61 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.206 -0.933 . . . . 0.0 110.543 -179.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -170.8 66.19 0.15 Allowed Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.42 -1.472 . . . . 0.0 109.42 -179.884 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.582 ' CE1' HD11 ' A' ' 20' ' ' ILE . 20.0 m-85 -125.09 16.37 8.47 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.434 -1.039 . . . . 0.0 110.481 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 ttmt -43.14 -31.3 0.56 Allowed 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.393 -0.817 . . . . 0.0 110.914 -179.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -74.6 -42.08 59.31 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.387 -0.82 . . . . 0.0 109.779 179.564 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -73.24 -44.57 59.28 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.48 -0.763 . . . . 0.0 109.848 179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.882 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -61.34 -33.55 73.81 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.391 -0.818 . . . . 0.0 110.043 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.42 -36.44 82.37 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 110.113 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.449 HD22 ' HE1' ' A' ' 12' ' ' HIS . 4.8 tt -60.12 -56.96 15.26 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.421 -0.8 . . . . 0.0 110.23 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.467 HD11 ' CE1' ' A' ' 12' ' ' HIS . 1.6 mp -69.24 -35.69 76.39 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.25 -0.906 . . . . 0.0 110.072 179.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.698 ' HA ' HD12 ' A' ' 91' ' ' ILE . 49.1 t60 -62.15 -37.57 85.71 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.298 -0.876 . . . . 0.0 110.284 -179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -65.96 -17.56 64.75 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.299 -0.875 . . . . 0.0 110.426 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -102.57 -2.11 50.1 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 110.225 -1.15 . . . . 0.0 110.225 -179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.698 HD12 ' HA ' ' A' ' 88' ' ' HIS . 18.5 mt -72.04 -55.48 5.14 Favored Pre-proline 0 N--CA 1.492 1.644 0 O-C-N 121.027 -1.278 . . . . 0.0 110.34 -179.912 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.562 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.1 Cg_endo -71.29 -89.46 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.337 0 O-C-N 123.265 1.139 . . . . 0.0 110.54 179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.56 HG12 ' H ' ' A' ' 95' ' ' SER . 87.8 t -150.16 146.26 16.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.031 -1.043 . . . . 0.0 109.959 179.994 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.778 HG23 ' HE3' ' A' ' 4' ' ' LYS . 59.1 t -70.68 -32.35 49.06 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.348 -0.845 . . . . 0.0 110.027 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.56 ' H ' HG12 ' A' ' 93' ' ' VAL . 32.2 t -70.24 -27.15 64.23 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.314 -0.866 . . . . 0.0 110.294 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 4.0 m -68.73 -65.64 0.68 Allowed 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.311 -0.868 . . . . 0.0 110.169 -179.979 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 13.0 p . . . . . 0 N--CA 1.493 1.688 0 CA-C-O 117.965 -1.017 . . . . 0.0 110.207 -179.933 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.7 mtp . . . . . 0 N--CA 1.492 1.626 0 CA-C-O 121.162 0.506 . . . . 0.0 110.263 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 8.9 p-10 -80.99 149.12 29.45 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.398 -0.814 . . . . 0.0 110.3 179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -73.08 -24.8 60.71 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.388 -0.82 . . . . 0.0 110.312 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -56.19 -39.5 72.5 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.32 -0.863 . . . . 0.0 110.458 -179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.414 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -62.09 -36.98 83.33 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.287 -0.883 . . . . 0.0 110.188 -179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.505 ' HG3' HD12 ' A' ' 61' ' ' LEU . 42.6 ttp180 -72.01 -44.09 63.99 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.221 179.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -64.89 -25.21 67.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.296 -0.877 . . . . 0.0 110.238 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.7 t -62.75 -57.59 10.41 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.338 -0.851 . . . . 0.0 110.141 179.92 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.731 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.8 OUTLIER -56.4 -34.75 67.03 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.315 -0.866 . . . . 0.0 110.131 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 90.9 mt -80.6 -20.34 43.48 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.35 -0.844 . . . . 0.0 110.429 179.895 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -110.53 31.49 5.92 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -0.856 . . . . 0.0 110.381 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.448 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 4.5 t-160 -142.41 45.0 1.64 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.351 -0.843 . . . . 0.0 109.987 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 69.1 ttp85 -75.09 -37.31 61.59 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.442 -0.786 . . . . 0.0 110.507 -179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -55.43 -35.47 65.44 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.175 -0.953 . . . . 0.0 110.595 -179.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.448 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -85.59 -56.3 3.57 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.288 -0.882 . . . . 0.0 110.312 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.74 HD23 HG13 ' A' ' 57' ' ' ILE . 56.7 tp -55.85 -42.64 76.13 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.343 -0.848 . . . . 0.0 110.59 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -60.51 -49.29 78.16 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 0.0 110.079 179.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 58.4 tttt -72.19 -26.35 62.02 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.364 -0.835 . . . . 0.0 110.04 179.869 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -72.41 -58.65 3.22 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.341 -0.85 . . . . 0.0 110.09 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.723 HD13 HG21 ' A' ' 25' ' ' ILE . 22.8 mt -135.59 109.86 10.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.366 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.567 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.8 mttt -79.45 142.67 35.67 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.556 -0.715 . . . . 0.0 109.558 179.359 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.567 ' C ' ' O ' ' A' ' 21' ' ' LYS . 61.6 p -23.75 97.34 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.391 0 CA-C-O 121.454 0.645 . . . . 0.0 111.09 -179.468 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.446 ' O ' ' C ' ' A' ' 24' ' ' TYR . 32.7 t -152.87 -176.52 5.79 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.712 -0.617 . . . . 0.0 110.222 -178.842 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.446 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.7 t80 -33.0 -44.5 0.11 Allowed 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.826 -0.546 . . . . 0.0 111.957 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.723 HG21 HD13 ' A' ' 20' ' ' ILE . 43.0 mm -54.74 -63.43 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.823 0 O-C-N 121.075 -1.016 . . . . 0.0 110.195 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.515 ' CE ' HD11 ' A' ' 16' ' ' LEU . 15.1 mtt -75.37 -39.03 59.69 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.265 -0.897 . . . . 0.0 110.362 179.986 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t0 -59.79 -51.47 69.59 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.367 -0.833 . . . . 0.0 110.565 -179.719 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 10.7 t-80 -54.47 -36.1 63.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.268 -0.895 . . . . 0.0 110.337 -179.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -63.08 -32.19 73.5 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.38 -0.825 . . . . 0.0 110.079 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.634 HD13 HD13 ' A' ' 35' ' ' LEU . 47.2 mm -60.78 -65.13 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.73 0 O-C-N 121.295 -0.878 . . . . 0.0 110.062 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 13.6 m -68.67 -18.62 64.31 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.395 -0.816 . . . . 0.0 110.551 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.11 -24.44 25.89 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.184 -0.947 . . . . 0.0 110.374 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 134.87 -13.94 4.42 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.985 -1.246 . . . . 0.0 109.985 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.497 ' CB ' HD12 ' A' ' 35' ' ' LEU . 25.0 m-85 -69.62 -55.24 10.61 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.182 -1.187 . . . . 0.0 110.454 -179.839 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.634 HD13 HD13 ' A' ' 30' ' ' ILE . 4.6 mp -121.83 165.17 16.29 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.326 -0.859 . . . . 0.0 110.416 -179.761 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 7.0 p -65.16 147.68 53.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.249 -0.907 . . . . 0.0 110.24 -179.992 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 10.1 mt -73.14 -20.85 18.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.412 -0.805 . . . . 0.0 110.219 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.4 m -57.91 -36.79 72.95 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.228 -0.92 . . . . 0.0 110.356 -179.88 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.453 ' O ' HG23 ' A' ' 43' ' ' VAL . 35.2 tt0 -63.61 -26.84 68.87 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.368 -0.833 . . . . 0.0 110.212 -179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 9.2 tm-20 -68.69 -45.31 72.01 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.327 -0.858 . . . . 0.0 110.136 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -63.13 -36.42 83.55 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.316 -0.865 . . . . 0.0 110.152 179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -76.61 -58.24 3.4 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.423 -0.798 . . . . 0.0 110.179 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.453 HG23 ' O ' ' A' ' 39' ' ' GLU . 68.9 t -50.83 -33.55 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.384 -0.823 . . . . 0.0 110.346 179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 51.6 ttt180 -46.06 -32.4 2.82 Favored 'General case' 0 N--CA 1.496 1.874 0 O-C-N 121.509 -0.744 . . . . 0.0 111.468 -179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -145.42 21.7 1.51 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.01 -1.057 . . . . 0.0 111.309 -179.581 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.442 ' CB ' ' HD3' ' A' ' 47' ' ' PRO . 0.3 OUTLIER -85.87 -54.53 0.41 Allowed Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.091 -1.006 . . . . 0.0 110.767 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.442 ' HD3' ' CB ' ' A' ' 46' ' ' GLU . 49.9 Cg_endo -77.22 163.87 29.84 Favored 'Trans proline' 0 C--N 1.311 -1.396 0 O-C-N 123.456 1.24 . . . . 0.0 110.614 -179.598 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.9 m -137.4 -42.96 0.55 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.348 -0.845 . . . . 0.0 110.054 179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -85.26 -161.25 0.57 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.056 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 -63.31 -15.07 56.17 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.299 -0.875 . . . . 0.0 110.636 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 0.59 ' HA ' ' HB3' ' A' ' 54' ' ' ALA . 52.6 tt0 -55.98 -20.16 15.33 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.193 -0.942 . . . . 0.0 110.664 -179.87 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.489 ' HG2' HG21 ' A' ' 22' ' ' THR . 25.7 ttm180 -51.45 -54.82 23.05 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.168 -0.958 . . . . 0.0 110.606 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -81.36 -29.2 34.15 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.331 -0.856 . . . . 0.0 110.188 179.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.59 ' HB3' ' HA ' ' A' ' 51' ' ' GLN . . . -62.45 -32.16 72.99 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.257 179.912 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 4.9 ttt -80.63 -48.16 13.06 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.427 -0.795 . . . . 0.0 110.31 179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.513 HD21 ' HB3' ' A' ' 26' ' ' MET . 23.4 tp -58.68 -36.36 74.07 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.379 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.74 HG13 HD23 ' A' ' 16' ' ' LEU . 0.2 OUTLIER -61.6 -44.47 98.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.679 0 O-C-N 121.434 -0.791 . . . . 0.0 109.672 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.8 mptm? -70.28 -36.77 74.61 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.47 -0.769 . . . . 0.0 110.06 179.884 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.404 ' O ' HD21 ' A' ' 35' ' ' LEU . 21.4 mmt -59.52 -36.53 76.3 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.339 -0.851 . . . . 0.0 110.367 179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.523 HD12 ' HA ' ' A' ' 57' ' ' ILE . 77.0 mt -60.67 -58.56 6.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.452 -0.78 . . . . 0.0 110.239 179.97 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.505 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.43 -40.28 77.35 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.31 -0.869 . . . . 0.0 110.572 -179.757 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 15.9 mmtt -59.08 -31.17 68.65 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.302 -0.874 . . . . 0.0 110.411 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -67.23 -65.09 0.73 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.319 -0.863 . . . . 0.0 110.183 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -160.16 158.62 30.48 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.288 -0.882 . . . . 0.0 110.213 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.8 m-20 -81.84 -26.86 33.92 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.456 -0.777 . . . . 0.0 110.194 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -63.52 -34.25 77.38 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.294 -0.879 . . . . 0.0 110.261 179.891 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 33.3 t -65.15 -36.89 85.65 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.353 -0.842 . . . . 0.0 110.155 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.625 ' HE1' HD23 ' A' ' 9' ' ' LEU . 18.9 t80 -59.25 -36.62 75.82 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.39 -0.819 . . . . 0.0 110.105 179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 56.4 t -68.75 -46.16 79.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.361 -0.837 . . . . 0.0 109.986 179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.5 t -62.02 -33.97 75.34 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.304 -0.873 . . . . 0.0 109.999 179.809 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.796 ' CE1' HD11 ' A' ' 75' ' ' LEU . 3.3 t80 -57.74 -36.67 72.38 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.35 -0.844 . . . . 0.0 109.787 179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.434 ' CE1' ' HB2' ' A' ' 88' ' ' HIS . 34.6 t80 -62.74 -41.86 99.38 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.496 -0.752 . . . . 0.0 109.941 179.831 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -79.81 -27.35 40.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.4 -0.813 . . . . 0.0 110.225 179.984 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.37 -47.79 84.56 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.325 -0.86 . . . . 0.0 110.192 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.796 HD11 ' CE1' ' A' ' 71' ' ' PHE . 7.8 mt -66.78 -41.17 88.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.328 -0.857 . . . . 0.0 110.224 179.928 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.423 HD21 ' HB3' ' A' ' 84' ' ' ALA . 43.6 mt -66.68 -15.11 63.27 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.421 -0.799 . . . . 0.0 110.57 -179.817 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 53.8 t-80 -61.96 -22.41 65.62 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.191 -0.943 . . . . 0.0 110.549 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -112.53 -75.15 0.61 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.22 -0.925 . . . . 0.0 110.426 -179.804 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.97 36.9 0.11 Allowed Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.9 m-85 -93.78 16.44 14.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.458 -1.025 . . . . 0.0 110.49 -179.93 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -42.19 -31.33 0.37 Allowed 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.522 -0.736 . . . . 0.0 110.906 -179.734 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -67.52 -48.1 68.01 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.356 -0.84 . . . . 0.0 109.703 179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.659 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -78.09 -44.02 27.41 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.508 -0.745 . . . . 0.0 109.827 179.671 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.423 ' HB3' HD21 ' A' ' 76' ' ' LEU . . . -59.15 -43.47 92.06 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.349 -0.844 . . . . 0.0 110.238 179.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.03 -29.72 70.48 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.35 -0.844 . . . . 0.0 110.11 179.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 30.7 tp -57.43 -46.09 83.93 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.355 -0.841 . . . . 0.0 110.309 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 1.2 mp -73.97 -33.42 63.86 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.241 -0.912 . . . . 0.0 110.21 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.856 ' HA ' HD12 ' A' ' 91' ' ' ILE . 13.3 t-160 -58.91 -25.77 63.71 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.348 -0.845 . . . . 0.0 110.386 179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 35.3 m-20 -85.04 -18.85 33.09 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.335 -0.853 . . . . 0.0 110.451 -179.972 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -97.08 -26.98 9.75 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.786 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.856 HD12 ' HA ' ' A' ' 88' ' ' HIS . 42.9 mt -56.87 -47.88 98.3 Favored Pre-proline 0 N--CA 1.493 1.708 0 O-C-N 121.352 -1.087 . . . . 0.0 110.977 -179.905 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.572 ' HD2' ' N ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo -70.44 -89.76 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.225 0 O-C-N 123.223 1.117 . . . . 0.0 110.72 -179.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.45 HG23 ' C ' ' A' ' 92' ' ' PRO . 60.7 t -147.82 145.42 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 120.897 -1.127 . . . . 0.0 110.268 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 58.4 t -122.33 -26.93 1.9 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.413 -0.804 . . . . 0.0 110.375 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 31.4 t -56.75 -73.5 0.06 Allowed 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.229 -0.92 . . . . 0.0 110.547 -179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 35.6 t -100.48 -71.05 0.72 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.324 -0.86 . . . . 0.0 110.338 -179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 20.1 m . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 117.998 -1.001 . . . . 0.0 110.215 -179.988 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.9 ttt . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.247 0.546 . . . . 0.0 110.174 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.9 p30 -92.77 129.11 38.8 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.369 -0.832 . . . . 0.0 110.292 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.74 -24.69 67.82 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.409 -0.807 . . . . 0.0 110.263 -179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -56.31 -29.35 61.14 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.329 -0.857 . . . . 0.0 110.575 -179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.69 -38.04 88.84 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.235 -0.915 . . . . 0.0 110.223 -179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 6.1 ttt180 -68.1 -28.51 67.4 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.33 -0.856 . . . . 0.0 110.206 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 69.7 m-20 -79.44 -27.21 41.68 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.351 -0.843 . . . . 0.0 110.121 179.944 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 49.1 t -61.62 -51.0 70.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.474 -0.766 . . . . 0.0 110.165 179.965 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.731 ' O ' HD13 ' A' ' 9' ' ' LEU . 3.0 tm? -62.53 -36.77 83.64 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.369 -0.832 . . . . 0.0 109.752 179.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 89.3 mt -72.47 -27.53 62.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.319 -0.863 . . . . 0.0 110.137 179.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -98.07 27.47 4.55 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.285 -0.884 . . . . 0.0 110.121 179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.917 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 3.5 t-160 -124.22 26.92 7.27 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.468 -0.77 . . . . 0.0 109.9 -179.885 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.4 ttp180 -75.68 -36.58 60.03 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.286 -0.884 . . . . 0.0 110.475 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.8 tt0 -68.36 -36.0 78.55 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.295 -0.878 . . . . 0.0 110.617 -179.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.917 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -85.05 -30.28 24.24 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.361 -0.837 . . . . 0.0 110.027 -179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.405 ' CD2' ' CG1' ' A' ' 57' ' ' ILE . 1.3 tp -80.72 -44.03 19.35 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.395 -0.815 . . . . 0.0 110.032 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 47.7 tt0 -59.16 -35.66 73.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.385 -0.822 . . . . 0.0 110.071 179.97 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 18.7 tttm -78.2 -41.78 33.48 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.38 -0.825 . . . . 0.0 110.285 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -85.24 -65.28 1.03 Allowed 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.241 -0.912 . . . . 0.0 110.514 -179.775 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.645 HD12 HG21 ' A' ' 25' ' ' ILE . 12.8 mm -94.95 109.69 22.71 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.544 ' O ' ' C ' ' A' ' 22' ' ' THR . 2.7 mtpm? -103.28 141.3 36.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.59 -0.694 . . . . 0.0 109.284 179.15 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.692 HG21 ' HD3' ' A' ' 52' ' ' ARG . 73.4 p -24.68 98.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.348 0 O-C-N 121.677 -0.64 . . . . 0.0 110.987 -179.551 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.438 ' O ' ' C ' ' A' ' 24' ' ' TYR . 81.4 p -159.97 -176.58 5.76 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.559 -0.713 . . . . 0.0 110.377 -178.628 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.438 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.7 t80 -33.55 -39.35 0.06 Allowed 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.86 -0.525 . . . . 0.0 111.939 -179.702 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.645 HG21 HD12 ' A' ' 20' ' ' ILE . 44.8 mm -57.23 -65.69 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.829 0 O-C-N 121.029 -1.044 . . . . 0.0 109.997 -179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.437 ' SD ' HD11 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -76.11 -40.87 51.94 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 110.189 179.711 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.2 t70 -55.02 -60.02 3.95 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.363 -0.835 . . . . 0.0 110.717 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 9.4 t-160 -56.73 -38.82 72.89 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.35 -0.844 . . . . 0.0 110.457 -179.694 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.557 ' HE3' HG23 ' A' ' 60' ' ' ILE . 4.5 ttp -62.99 -28.11 69.87 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.377 -179.845 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.557 HG23 ' HB2' ' A' ' 35' ' ' LEU . 27.2 mt -83.85 -34.55 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.259 -0.9 . . . . 0.0 110.29 -179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 18.0 m -87.26 -18.73 29.55 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.294 -0.879 . . . . 0.0 110.512 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -57.58 -23.7 52.23 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.238 -0.914 . . . . 0.0 110.38 -179.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 141.23 -17.13 2.72 Favored Glycine 0 N--CA 1.492 2.375 0 N-CA-C 109.821 -1.311 . . . . 0.0 109.821 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.64 ' C ' HD22 ' A' ' 35' ' ' LEU . 7.1 m-30 -53.84 -66.6 0.36 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.237 -1.154 . . . . 0.0 110.333 -179.906 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.64 HD22 ' C ' ' A' ' 34' ' ' PHE . 4.0 mm? -106.44 165.15 11.48 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.488 -0.757 . . . . 0.0 110.058 -179.947 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 81.3 p -59.59 169.34 1.34 Allowed 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.432 -0.792 . . . . 0.0 110.273 -179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.8 mt -84.68 -24.45 7.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.384 -0.823 . . . . 0.0 110.158 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 19.4 m -58.91 -24.53 62.47 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.348 -0.845 . . . . 0.0 110.365 -179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -60.67 -35.88 77.35 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.31 -0.869 . . . . 0.0 110.242 -179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.8 tt0 -61.45 -36.34 80.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.334 -0.854 . . . . 0.0 110.211 179.938 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 -70.75 -27.04 63.64 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.341 -0.849 . . . . 0.0 110.096 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.9 ttmt -82.95 -61.75 1.78 Allowed 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.378 -0.826 . . . . 0.0 110.188 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 61.7 t -48.05 -33.75 4.14 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.934 0 O-C-N 121.585 -0.697 . . . . 0.0 110.838 -179.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttm-85 -45.98 -47.22 16.69 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.486 -0.759 . . . . 0.0 111.279 -179.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.2 m120 -144.99 23.82 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.147 -0.971 . . . . 0.0 110.893 -179.701 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.611 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 1.1 tm-20 -81.82 -48.91 0.95 Allowed Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.131 -0.981 . . . . 0.0 110.863 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.611 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.2 Cg_endo -75.99 169.88 21.23 Favored 'Trans proline' 0 C--N 1.316 -1.156 0 O-C-N 123.127 1.067 . . . . 0.0 110.526 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 23.4 m -136.69 -41.97 0.61 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.404 -0.81 . . . . 0.0 110.139 179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 80.3 mm-40 -100.2 -152.88 0.43 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.413 -0.805 . . . . 0.0 110.009 179.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.7 pt20 -71.21 -7.65 48.23 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.222 -0.924 . . . . 0.0 110.66 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 23.9 tt0 -55.72 -21.28 17.85 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.108 -0.995 . . . . 0.0 110.663 -179.902 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.692 ' HD3' HG21 ' A' ' 22' ' ' THR . 20.3 ttm180 -52.76 -32.46 43.59 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.25 -0.906 . . . . 0.0 110.557 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.491 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -91.57 -11.67 36.6 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.299 -0.876 . . . . 0.0 110.524 179.951 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.65 -42.76 14.02 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.077 -1.014 . . . . 0.0 110.244 179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.41 -43.02 24.17 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.312 -0.867 . . . . 0.0 110.219 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.506 HD22 HG22 ' A' ' 22' ' ' THR . 18.2 tp -60.15 -38.73 84.02 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.245 -0.91 . . . . 0.0 110.125 179.97 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.573 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 1.2 mp -76.51 -34.33 24.23 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.368 -0.833 . . . . 0.0 109.684 179.747 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mtmm -68.06 -38.11 82.06 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.323 -0.861 . . . . 0.0 109.641 179.505 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 3.0 mtt -59.88 -35.02 73.95 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.414 -0.804 . . . . 0.0 110.029 179.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.557 HG23 ' HE3' ' A' ' 29' ' ' MET . 95.8 mt -58.27 -52.33 60.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.396 -0.815 . . . . 0.0 110.036 179.716 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.42 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -75.18 -22.19 58.21 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.39 -0.819 . . . . 0.0 110.763 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.51 -27.36 63.16 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.252 -0.905 . . . . 0.0 110.585 -179.783 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.521 ' HB2' HD11 ' A' ' 35' ' ' LEU . 47.5 tptt -70.8 -65.17 0.77 Allowed 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.263 -0.898 . . . . 0.0 110.208 -179.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 10.3 t0 -160.11 155.51 25.26 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.404 -0.81 . . . . 0.0 110.275 -179.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 81.0 m-20 -69.8 -28.19 65.51 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.464 -0.773 . . . . 0.0 110.125 179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 65.3 m-20 -62.41 -37.1 84.52 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.465 -0.772 . . . . 0.0 110.213 179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 14.1 t -60.93 -33.22 72.82 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.294 -0.879 . . . . 0.0 110.174 179.895 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.64 ' HE1' HD23 ' A' ' 9' ' ' LEU . 15.6 t80 -64.86 -39.93 94.34 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.464 -0.772 . . . . 0.0 110.118 179.896 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.45 -31.79 52.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.335 -0.853 . . . . 0.0 110.074 179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.6 t -70.61 -38.93 74.0 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.353 -0.842 . . . . 0.0 109.984 179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.575 ' CE2' HD22 ' A' ' 87' ' ' LEU . 5.0 t80 -54.82 -38.19 67.07 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.385 -0.822 . . . . 0.0 109.818 179.746 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.703 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.0 t80 -65.08 -46.87 79.36 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.377 -0.827 . . . . 0.0 109.941 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.446 ' HA ' HD12 ' A' ' 76' ' ' LEU . 4.0 t30 -72.02 -25.95 62.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.369 -0.832 . . . . 0.0 110.42 -179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.32 -45.03 74.05 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.26 -0.9 . . . . 0.0 110.178 -179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.544 HD11 ' CE1' ' A' ' 71' ' ' PHE . 28.5 mt -68.56 -38.17 80.52 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.325 -0.859 . . . . 0.0 110.353 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.703 HD11 ' CE1' ' A' ' 72' ' ' TYR . 22.6 mt -66.38 -15.17 63.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.349 -0.844 . . . . 0.0 110.576 -179.861 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 1.3 t60 -63.04 -22.81 67.11 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.214 -0.929 . . . . 0.0 110.549 -179.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -109.49 -75.46 0.63 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.212 -0.93 . . . . 0.0 110.407 -179.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.2 35.94 0.1 Allowed Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.373 -1.491 . . . . 0.0 109.373 -179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 31.4 m-85 -95.28 16.2 17.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.509 -0.995 . . . . 0.0 110.449 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.41 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 11.9 ttpt -46.48 -30.58 2.26 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.392 -0.817 . . . . 0.0 110.973 -179.735 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 -62.09 -60.92 2.9 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.285 -0.884 . . . . 0.0 109.821 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.504 HD23 ' O ' ' A' ' 83' ' ' LEU . 5.5 tt -71.28 -43.8 66.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.442 -0.786 . . . . 0.0 109.992 179.67 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.27 -40.53 71.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.444 -0.785 . . . . 0.0 110.305 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.41 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.57 -35.17 75.42 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.276 -0.89 . . . . 0.0 110.124 179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.636 HD23 ' CE1' ' A' ' 12' ' ' HIS . 19.3 tp -61.69 -28.24 69.26 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.369 -0.832 . . . . 0.0 110.271 179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.575 HD22 ' CE2' ' A' ' 71' ' ' PHE . 0.6 OUTLIER -84.62 -39.52 18.58 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.31 -0.869 . . . . 0.0 110.429 -179.935 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.846 ' HA ' HD12 ' A' ' 91' ' ' ILE . 48.5 t-80 -67.36 -47.8 69.34 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 46.5 m-20 -69.59 -15.07 63.14 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.349 -0.844 . . . . 0.0 110.562 -179.726 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -91.37 -16.38 53.23 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.846 HD12 ' HA ' ' A' ' 88' ' ' HIS . 18.7 mt -66.54 -53.77 27.56 Favored Pre-proline 0 N--CA 1.493 1.715 0 O-C-N 121.159 -1.201 . . . . 0.0 110.436 -179.798 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.576 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.3 Cg_endo -71.84 -83.85 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.331 0 O-C-N 123.336 1.177 . . . . 0.0 110.706 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.446 HG12 ' N ' ' A' ' 94' ' ' VAL . 59.8 t -127.29 164.49 28.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.093 -1.005 . . . . 0.0 110.161 -179.939 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.446 ' N ' HG12 ' A' ' 93' ' ' VAL . 57.6 t -91.82 -62.9 1.54 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.445 -0.784 . . . . 0.0 110.17 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 20.7 t -164.83 -55.74 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.312 -0.868 . . . . 0.0 110.266 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.4 m -114.44 -65.08 1.23 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.287 -0.883 . . . . 0.0 110.23 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 60.2 m . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 117.984 -1.008 . . . . 0.0 110.236 -179.97 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.161 0.505 . . . . 0.0 110.247 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -143.91 142.59 30.86 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.355 -0.841 . . . . 0.0 110.248 -179.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -64.38 -25.46 68.03 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.451 -0.78 . . . . 0.0 110.272 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 32.9 ttpt -58.17 -50.46 73.46 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.317 -0.865 . . . . 0.0 110.269 -179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.708 ' CB ' HG23 ' A' ' 91' ' ' ILE . . . -61.21 -35.65 77.77 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.286 -0.884 . . . . 0.0 109.786 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.571 ' HG3' HD12 ' A' ' 61' ' ' LEU . 23.0 ttm-85 -68.42 -36.01 78.45 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.393 -0.817 . . . . 0.0 109.79 179.623 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.7 m120 -65.5 -32.86 74.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.473 -0.767 . . . . 0.0 109.937 179.716 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 42.4 t -57.57 -59.83 4.58 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.312 -0.868 . . . . 0.0 110.082 179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.938 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.4 tm? -59.33 -34.85 72.85 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.349 -0.844 . . . . 0.0 109.953 179.724 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 78.5 mt -73.62 -28.0 61.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.367 -0.833 . . . . 0.0 110.054 179.638 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -93.66 1.98 56.45 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.42 -0.8 . . . . 0.0 110.567 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.635 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 4.3 t60 -98.15 28.99 3.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.155 -0.966 . . . . 0.0 109.696 179.975 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 37.5 ttm180 -71.01 -55.25 8.68 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.295 -0.878 . . . . 0.0 110.304 -179.866 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -61.41 -34.58 75.6 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.834 . . . . 0.0 110.245 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.635 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -74.2 -34.72 63.81 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.293 -0.879 . . . . 0.0 110.133 179.933 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.66 HD13 HG13 ' A' ' 57' ' ' ILE . 8.3 tt -77.16 -40.81 44.09 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.464 -0.773 . . . . 0.0 110.39 -179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -51.8 -41.88 62.04 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.28 -0.888 . . . . 0.0 110.405 -179.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 20.6 ttpt -85.5 -32.0 22.46 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.343 -0.848 . . . . 0.0 110.548 179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.627 ' HB3' HD11 ' A' ' 83' ' ' LEU . 70.6 m-20 -85.18 -65.53 1.0 Allowed 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.879 . . . . 0.0 111.01 -179.339 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.473 HD12 HG21 ' A' ' 25' ' ' ILE . 13.4 mm -114.58 122.33 68.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.23 -0.919 . . . . 0.0 110.569 -179.32 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.553 ' O ' ' C ' ' A' ' 22' ' ' THR . 19.2 mtmm -113.75 141.89 46.72 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.631 -0.668 . . . . 0.0 109.23 179.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.809 HG22 HD22 ' A' ' 56' ' ' LEU . 74.0 p -24.1 97.53 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.652 -0.655 . . . . 0.0 111.149 -179.39 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.426 ' O ' ' C ' ' A' ' 24' ' ' TYR . 34.9 t -160.63 -176.75 5.74 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.487 -0.758 . . . . 0.0 110.557 -178.758 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.426 ' C ' ' O ' ' A' ' 23' ' ' SER . 8.1 t80 -33.57 -46.67 0.2 Allowed 'General case' 0 N--CA 1.501 2.094 0 O-C-N 121.899 -0.501 . . . . 0.0 112.168 -179.663 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.473 HG21 HD12 ' A' ' 20' ' ' ILE . 38.6 mm -49.91 -64.67 0.29 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.947 0 O-C-N 121.06 -1.025 . . . . 0.0 110.527 -179.567 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.586 ' HE2' HD11 ' A' ' 16' ' ' LEU . 4.5 mmt -72.75 -53.5 11.45 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.345 -0.847 . . . . 0.0 110.367 -179.883 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -46.64 -43.92 17.93 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.51 -0.744 . . . . 0.0 111.067 -179.615 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 58.0 t60 -59.64 -37.35 78.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.119 -0.988 . . . . 0.0 109.846 179.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 29.9 mmt -80.26 -28.23 38.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.419 -0.801 . . . . 0.0 110.199 179.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.711 HG21 ' OE1' ' A' ' 40' ' ' GLU . 29.4 mm -64.41 -50.45 76.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.351 -0.843 . . . . 0.0 109.937 179.899 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.0 m -75.71 -19.74 58.87 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.348 -0.845 . . . . 0.0 110.483 -179.749 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.73 -24.07 47.07 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.164 -0.96 . . . . 0.0 110.358 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.47 -17.52 2.06 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.968 -1.253 . . . . 0.0 109.968 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.637 ' C ' HD22 ' A' ' 35' ' ' LEU . 12.6 m-30 -56.23 -72.33 0.08 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.217 -1.166 . . . . 0.0 110.451 -179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.637 HD22 ' C ' ' A' ' 34' ' ' PHE . 4.0 mm? -106.47 161.82 14.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.293 -0.879 . . . . 0.0 110.227 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.5 p -70.67 162.5 28.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.403 -0.811 . . . . 0.0 110.095 179.827 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 25.0 mt -79.25 -29.13 13.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.287 -0.883 . . . . 0.0 110.06 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 70.9 m -61.97 -33.16 73.79 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.405 -0.809 . . . . 0.0 110.171 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.711 ' O ' HG23 ' A' ' 43' ' ' VAL . 25.5 tt0 -75.02 -26.74 59.71 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.385 -0.822 . . . . 0.0 110.316 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.711 ' OE1' HG21 ' A' ' 30' ' ' ILE . 9.1 tp10 -74.0 -39.02 63.93 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.288 -0.882 . . . . 0.0 110.313 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -62.13 -35.93 80.23 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.296 -0.878 . . . . 0.0 110.261 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.401 ' O ' ' N ' ' A' ' 46' ' ' GLU . 16.0 tttt -72.29 -41.89 66.14 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.388 -0.82 . . . . 0.0 110.201 179.959 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.711 HG23 ' O ' ' A' ' 39' ' ' GLU . 98.9 t -58.26 -34.47 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 121.344 -0.848 . . . . 0.0 110.38 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.7 ttt180 -55.87 -24.78 38.98 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.333 -0.854 . . . . 0.0 110.959 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -142.69 15.4 1.96 Allowed 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.128 -0.982 . . . . 0.0 111.073 -179.71 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.629 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 34.1 tt0 -81.85 -51.19 0.83 Allowed Pre-proline 0 N--CA 1.492 1.655 0 O-C-N 121.017 -1.052 . . . . 0.0 110.585 -179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.629 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.5 Cg_endo -76.61 170.2 20.37 Favored 'Trans proline' 0 C--N 1.314 -1.252 0 O-C-N 123.201 1.106 . . . . 0.0 110.404 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 18.3 m -124.71 -39.04 2.32 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.36 -0.837 . . . . 0.0 110.274 179.919 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 23.8 mm100 -104.31 -153.48 0.48 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.307 -0.871 . . . . 0.0 110.053 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -8.73 51.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.211 -0.931 . . . . 0.0 110.656 -179.857 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 32.6 tt0 -52.06 -24.97 7.56 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.114 -0.991 . . . . 0.0 110.65 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.704 ' HG2' HG21 ' A' ' 22' ' ' THR . 24.2 ttp180 -52.95 -25.26 11.37 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.246 -0.909 . . . . 0.0 110.544 -179.886 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.445 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -86.96 -26.32 23.89 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.309 -0.87 . . . . 0.0 110.315 -179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -77.82 -29.41 50.64 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.297 -0.877 . . . . 0.0 110.373 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.3 ttt -79.16 -52.47 8.13 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.304 -0.872 . . . . 0.0 110.481 -179.73 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.809 HD22 HG22 ' A' ' 22' ' ' THR . 32.1 tp -51.08 -35.06 33.03 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.375 -0.828 . . . . 0.0 110.95 -179.603 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.705 ' HA ' HD12 ' A' ' 60' ' ' ILE . 0.8 OUTLIER -72.78 -32.19 39.55 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.219 -0.926 . . . . 0.0 110.265 -179.839 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.9 tttp -70.87 -35.63 72.47 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.23 -0.919 . . . . 0.0 110.348 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.467 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.1 OUTLIER -65.04 -29.49 70.39 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.229 -0.919 . . . . 0.0 110.141 179.672 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.705 HD12 ' HA ' ' A' ' 57' ' ' ILE . 96.6 mt -62.74 -53.55 45.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.283 -0.886 . . . . 0.0 109.684 179.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.571 HD12 ' HG3' ' A' ' 6' ' ' ARG . 2.1 mm? -73.67 -37.22 65.34 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.434 -0.791 . . . . 0.0 110.399 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 23.1 mmtt -60.34 -27.55 67.45 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.336 -0.853 . . . . 0.0 110.524 -179.809 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.1 tmtt? -78.67 -64.66 1.12 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.154 -179.96 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 9.9 t70 -160.2 153.89 22.61 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.351 -0.843 . . . . 0.0 110.207 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 -74.96 -24.13 58.41 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.298 -0.876 . . . . 0.0 110.32 179.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -62.15 -36.82 83.0 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.313 -0.867 . . . . 0.0 110.114 179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.8 t -61.66 -31.47 71.59 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.468 -0.77 . . . . 0.0 110.061 179.818 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.938 ' CE1' HD23 ' A' ' 9' ' ' LEU . 8.7 t80 -68.2 -38.53 82.06 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.323 -0.861 . . . . 0.0 110.008 179.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 54.1 t -67.7 -42.54 86.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.345 -0.847 . . . . 0.0 110.105 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 30.8 t -62.96 -39.13 93.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.293 -0.88 . . . . 0.0 109.938 179.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.72 ' CE2' HD11 ' A' ' 75' ' ' LEU . 1.8 t80 -53.25 -36.62 61.3 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.469 -0.77 . . . . 0.0 109.824 179.687 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.687 ' CE1' HD11 ' A' ' 76' ' ' LEU . 31.3 t80 -63.53 -45.91 88.39 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.308 -0.87 . . . . 0.0 110.075 179.836 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 0.459 ' HA ' HD12 ' A' ' 76' ' ' LEU . 5.5 t30 -75.98 -23.07 55.28 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.308 -0.87 . . . . 0.0 110.583 -179.798 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.11 -33.99 75.53 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.176 -0.952 . . . . 0.0 110.403 -179.839 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.72 HD11 ' CE2' ' A' ' 71' ' ' PHE . 4.3 mt -84.79 -33.69 22.93 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.34 -0.85 . . . . 0.0 110.432 -179.709 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.708 HD21 ' CB ' ' A' ' 84' ' ' ALA . 26.6 mt -67.65 -14.93 63.37 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.375 -0.828 . . . . 0.0 110.584 -179.814 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 49.8 t60 -66.51 -24.45 66.39 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.158 -0.964 . . . . 0.0 110.507 -179.893 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 15.4 mt-10 -103.26 -75.1 0.62 Allowed 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.219 -0.926 . . . . 0.0 110.504 -179.884 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.85 48.3 0.15 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.5 -1.44 . . . . 0.0 109.5 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 40.7 m-85 -106.27 16.16 25.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.435 -1.038 . . . . 0.0 110.495 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -46.14 -32.74 3.11 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.387 -0.82 . . . . 0.0 110.735 -179.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -68.63 -63.59 1.03 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 109.856 179.76 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.724 HD23 ' O ' ' A' ' 83' ' ' LEU . 4.7 tt -62.79 -36.43 83.11 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.402 -0.811 . . . . 0.0 109.89 179.843 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.708 ' CB ' HD21 ' A' ' 76' ' ' LEU . . . -59.95 -36.69 77.62 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.469 -0.769 . . . . 0.0 110.044 179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -61.23 -34.27 74.86 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.455 -0.778 . . . . 0.0 110.07 179.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.654 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.89 -47.48 84.77 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.451 -0.781 . . . . 0.0 109.926 179.906 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.41 ' O ' HD12 ' A' ' 91' ' ' ILE . 0.9 OUTLIER -72.1 -39.96 68.53 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.36 -0.838 . . . . 0.0 110.174 -179.948 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.653 ' HA ' HD12 ' A' ' 91' ' ' ILE . 27.5 t-80 -62.42 -55.54 26.83 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.38 -0.825 . . . . 0.0 110.173 179.917 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -72.5 -24.78 61.21 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.411 -0.806 . . . . 0.0 110.302 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -75.04 -14.44 81.81 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.708 HG23 ' CB ' ' A' ' 5' ' ' ALA . 7.9 mt -72.84 -57.64 3.02 Favored Pre-proline 0 N--CA 1.493 1.683 0 O-C-N 121.211 -1.17 . . . . 0.0 110.328 -179.761 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.591 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 47.1 Cg_endo -72.73 -30.97 11.06 Favored 'Trans proline' 0 C--N 1.314 -1.274 0 O-C-N 123.29 1.153 . . . . 0.0 110.467 179.941 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 60.1 t -111.61 141.41 27.13 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.329 -0.857 . . . . 0.0 110.104 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 95.9 t -71.67 -78.41 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.47 -0.769 . . . . 0.0 110.246 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 4.8 t -137.41 5.33 2.71 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.257 -0.902 . . . . 0.0 110.822 -179.848 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 40.4 t -58.03 -28.47 64.5 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.063 -1.023 . . . . 0.0 110.419 -179.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.119 -179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.253 0.549 . . . . 0.0 110.141 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.423 ' OD1' ' N ' ' A' ' 2' ' ' ASP . 39.0 p-10 -86.75 100.03 12.2 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.339 -0.851 . . . . 0.0 110.364 -179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.14 -45.85 38.2 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.255 -0.903 . . . . 0.0 110.227 -179.948 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 29.7 ttpp -59.44 -37.44 78.12 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.399 -0.813 . . . . 0.0 110.212 -179.985 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.21 -38.21 79.34 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.276 -0.89 . . . . 0.0 109.921 179.864 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.658 ' HG3' HD12 ' A' ' 61' ' ' LEU . 47.2 ttt180 -64.64 -31.93 73.37 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.381 -0.824 . . . . 0.0 109.778 179.643 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 14.3 m120 -75.68 -27.79 58.43 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.431 -0.793 . . . . 0.0 110.028 179.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 10.9 t -61.83 -60.44 3.64 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.319 -0.863 . . . . 0.0 110.168 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.748 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.8 OUTLIER -53.33 -34.89 59.31 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.359 -0.838 . . . . 0.0 110.105 179.833 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 48.9 mt -79.97 -26.22 40.07 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.355 -0.84 . . . . 0.0 110.273 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 24.7 tt0 -110.15 33.25 4.56 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.407 -0.808 . . . . 0.0 110.337 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.439 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 4.6 t-160 -146.39 43.54 1.2 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.331 -0.855 . . . . 0.0 110.081 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 66.3 ttp85 -75.36 -31.5 60.55 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.443 -0.786 . . . . 0.0 110.297 -179.951 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.07 -34.43 70.12 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.225 -0.922 . . . . 0.0 110.402 -179.833 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.439 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -84.93 -42.43 14.98 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.412 -0.805 . . . . 0.0 110.094 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.703 HD22 HG12 ' A' ' 57' ' ' ILE . 9.2 tt -63.1 -37.37 86.93 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.385 -0.822 . . . . 0.0 110.19 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -76.09 -32.07 59.04 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.435 -0.79 . . . . 0.0 110.073 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 7.4 tttt -64.78 -49.66 69.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.43 -0.794 . . . . 0.0 110.128 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -84.55 -55.72 3.98 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.381 -0.825 . . . . 0.0 110.066 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.655 HG21 ' CE ' ' A' ' 26' ' ' MET . 14.9 mm -98.95 158.19 3.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.292 -0.88 . . . . 0.0 109.995 179.89 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.561 ' O ' ' C ' ' A' ' 22' ' ' THR . 50.9 mttt -154.14 141.52 19.66 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.477 -0.765 . . . . 0.0 109.481 -179.827 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.931 HG22 HD22 ' A' ' 56' ' ' LEU . 67.9 p -24.63 96.5 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.399 0 CA-C-O 121.47 0.652 . . . . 0.0 110.893 -179.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 42.7 m -163.36 -175.84 4.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.548 -0.72 . . . . 0.0 110.157 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.433 ' C ' ' O ' ' A' ' 23' ' ' SER . 11.2 t80 -33.08 -37.26 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.894 -0.504 . . . . 0.0 112.092 179.978 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.607 HG13 HD12 ' A' ' 20' ' ' ILE . 46.2 mm -54.63 -65.78 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.808 0 O-C-N 121.047 -1.033 . . . . 0.0 109.994 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.655 ' CE ' HG21 ' A' ' 20' ' ' ILE . 1.0 OUTLIER -76.43 -34.47 58.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.349 -0.844 . . . . 0.0 110.374 179.544 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 1.7 t70 -57.32 -41.88 80.8 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.364 -0.835 . . . . 0.0 110.553 -179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.8 t-160 -75.01 -50.37 16.76 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.308 -0.87 . . . . 0.0 110.37 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 1.1 mpp? -60.02 -50.33 74.14 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.338 -0.851 . . . . 0.0 110.437 -179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.908 HG23 ' HB2' ' A' ' 35' ' ' LEU . 98.6 mt -61.35 -28.66 44.34 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 O-C-N 121.459 -0.776 . . . . 0.0 110.297 -179.851 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.0 m -90.32 -23.0 21.27 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.353 -0.842 . . . . 0.0 110.354 -179.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -59.72 -21.48 60.72 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.332 -0.855 . . . . 0.0 110.421 -179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 144.24 -16.59 2.1 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.951 -1.26 . . . . 0.0 109.951 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.656 ' C ' HD22 ' A' ' 35' ' ' LEU . 7.4 m-30 -53.15 -71.56 0.07 Allowed 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.147 -1.208 . . . . 0.0 110.247 -179.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.908 ' HB2' HG23 ' A' ' 30' ' ' ILE . 4.0 mm? -108.12 164.12 12.57 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.406 -0.809 . . . . 0.0 109.908 179.87 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 5.8 p -62.53 144.33 56.17 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.376 -0.827 . . . . 0.0 110.197 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.554 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.5 mp -69.53 -22.97 25.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.377 -0.827 . . . . 0.0 110.24 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 39.1 m -57.02 -27.88 62.02 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.297 -0.877 . . . . 0.0 110.316 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -62.34 -37.46 85.72 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.38 -0.825 . . . . 0.0 110.077 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -60.55 -33.11 72.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.412 -0.805 . . . . 0.0 110.201 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -69.0 -31.13 69.73 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.316 -0.865 . . . . 0.0 110.229 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.411 ' HG2' ' CB ' ' A' ' 46' ' ' GLU . 1.6 ttmt -84.87 -59.47 2.34 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -0.841 . . . . 0.0 110.377 -179.886 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.442 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 88.7 t -48.5 -33.76 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.501 -0.749 . . . . 0.0 110.786 -179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -44.97 -45.43 10.54 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.554 -0.716 . . . . 0.0 111.421 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -144.49 15.2 1.62 Allowed 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.092 -1.005 . . . . 0.0 111.125 -179.595 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.623 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 3.0 tm-20 -79.94 -48.09 1.38 Allowed Pre-proline 0 N--CA 1.494 1.738 0 O-C-N 121.116 -0.99 . . . . 0.0 110.891 179.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.623 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -75.49 166.78 27.94 Favored 'Trans proline' 0 C--N 1.316 -1.152 0 O-C-N 123.121 1.063 . . . . 0.0 110.522 -179.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 10.3 m -136.44 -42.93 0.62 Allowed 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.438 -0.789 . . . . 0.0 110.174 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.6 mm100 -96.2 -159.23 0.71 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.35 -0.844 . . . . 0.0 110.129 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 7.1 pt20 -64.06 -14.58 55.56 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.313 -0.867 . . . . 0.0 110.641 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 37.7 tt0 -55.96 -19.96 14.39 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.271 -0.893 . . . . 0.0 110.721 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.3 ttm180 -49.69 -49.68 46.7 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.342 -0.849 . . . . 0.0 110.496 -179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -75.27 -42.98 53.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.396 -0.815 . . . . 0.0 110.323 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.43 -34.06 4.41 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.254 -0.904 . . . . 0.0 110.801 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 19.0 ttt -85.03 -24.75 28.05 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.306 -0.872 . . . . 0.0 110.019 179.616 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.931 HD22 HG22 ' A' ' 22' ' ' THR . 4.8 tp -82.01 -46.85 13.39 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.374 -0.828 . . . . 0.0 110.72 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.703 HG12 HD22 ' A' ' 16' ' ' LEU . 1.9 mp -68.63 -32.4 54.94 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.272 -0.893 . . . . 0.0 110.242 -179.843 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.4 mtpp -71.04 -39.45 72.29 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.238 -0.914 . . . . 0.0 110.062 179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 8.0 mmt -58.89 -29.24 66.87 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.355 -0.84 . . . . 0.0 110.338 -179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.62 HD12 ' HA ' ' A' ' 57' ' ' ILE . 92.9 mt -67.08 -59.9 3.23 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.368 -0.833 . . . . 0.0 110.078 179.959 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.658 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.25 -38.75 78.61 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.447 -0.783 . . . . 0.0 110.483 -179.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.3 mmtt -59.87 -25.37 65.01 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.323 -0.861 . . . . 0.0 110.387 -179.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.57 ' HB2' HD11 ' A' ' 35' ' ' LEU . 5.9 tptp -73.54 -65.43 0.82 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.279 -0.888 . . . . 0.0 110.2 -179.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.44 169.95 21.99 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.353 -0.842 . . . . 0.0 110.376 -179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 29.9 m120 -83.9 -26.09 29.66 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.469 -0.769 . . . . 0.0 110.14 179.845 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 -63.01 -40.78 98.8 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.369 -0.832 . . . . 0.0 110.008 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 34.4 t -60.06 -33.28 71.85 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.29 -0.881 . . . . 0.0 110.12 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.618 ' HE1' HD23 ' A' ' 9' ' ' LEU . 26.7 t80 -65.73 -40.96 92.7 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.39 -0.819 . . . . 0.0 109.892 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.7 t -68.2 -41.38 83.94 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.387 -0.821 . . . . 0.0 109.896 179.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 26.2 t -64.11 -32.7 74.36 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.351 -0.843 . . . . 0.0 110.017 179.916 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.645 ' CE1' HD11 ' A' ' 75' ' ' LEU . 7.8 t80 -57.97 -42.19 84.52 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.4 -0.813 . . . . 0.0 109.89 179.816 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.827 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 36.3 t80 -62.6 -37.95 88.27 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.389 -0.82 . . . . 0.0 110.251 179.913 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -76.96 -32.93 57.63 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.329 -0.857 . . . . 0.0 110.463 -179.811 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -62.58 -30.48 71.35 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.353 -0.842 . . . . 0.0 110.247 -179.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.649 HD23 ' CD2' ' A' ' 80' ' ' TYR . 6.4 mt -84.98 -39.63 17.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.404 -0.81 . . . . 0.0 110.339 -179.928 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.827 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 24.1 mt -68.85 -15.51 63.52 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.343 -0.848 . . . . 0.0 110.601 -179.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -68.9 -21.1 64.25 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.267 -0.896 . . . . 0.0 110.622 -179.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mt-10 -109.66 -75.34 0.63 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.176 -0.952 . . . . 0.0 110.499 -179.808 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.15 35.5 0.1 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.579 -1.408 . . . . 0.0 109.579 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.649 ' CD2' HD23 ' A' ' 75' ' ' LEU . 17.5 m-85 -98.35 16.43 21.59 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.378 -1.072 . . . . 0.0 110.438 -179.952 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 11.1 tttm -44.98 -29.79 0.9 Allowed 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.445 -0.784 . . . . 0.0 110.831 -179.787 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -73.64 -45.16 54.45 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.238 -0.914 . . . . 0.0 109.794 179.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.0 tm? -78.88 -40.19 33.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.505 -0.747 . . . . 0.0 109.861 179.776 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -65.24 -31.23 72.27 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.379 -0.826 . . . . 0.0 110.097 179.875 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.434 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -68.8 -34.87 76.24 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.45 -0.781 . . . . 0.0 110.21 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.9 tp -60.0 -45.76 91.7 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.382 -0.824 . . . . 0.0 110.394 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.441 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.2 mt -77.38 -24.59 50.59 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.349 -0.844 . . . . 0.0 110.441 -179.888 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.518 ' HA ' HD12 ' A' ' 91' ' ' ILE . 33.2 t-80 -79.11 -42.51 26.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.264 -0.897 . . . . 0.0 110.488 -179.797 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 37.6 m-20 -60.76 -19.92 60.23 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.309 -0.87 . . . . 0.0 110.494 -179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . 0.621 ' HA2' HG22 ' A' ' 94' ' ' VAL . . . -86.63 -19.26 56.94 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 110.017 -1.233 . . . . 0.0 110.017 -179.761 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.61 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 78.7 mt -61.95 -51.14 77.43 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.187 -1.184 . . . . 0.0 110.728 -179.763 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.61 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.6 Cg_endo -71.72 -85.17 0.0 OUTLIER 'Trans proline' 0 C--N 1.315 -1.211 0 O-C-N 123.116 1.061 . . . . 0.0 110.635 -179.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 56.4 t -135.19 146.78 29.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.097 -1.002 . . . . 0.0 110.125 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.621 HG22 ' HA2' ' A' ' 90' ' ' GLY . 59.3 t -116.17 -26.69 2.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.37 -0.831 . . . . 0.0 110.224 -179.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 39.6 t -59.84 -49.08 79.09 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.276 -0.89 . . . . 0.0 110.362 -179.895 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 1.2 m -75.65 -54.95 6.15 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.337 -0.852 . . . . 0.0 110.185 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 29.0 t . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 117.991 -1.004 . . . . 0.0 110.195 179.999 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.3 ttm . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.164 0.506 . . . . 0.0 110.205 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -115.3 144.62 43.47 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.316 -0.865 . . . . 0.0 110.277 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.22 -25.0 59.41 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.403 -0.81 . . . . 0.0 110.295 179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 3.8 ttpm? -60.25 -31.62 70.37 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.253 -0.904 . . . . 0.0 110.391 -179.922 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.551 ' HB1' HG23 ' A' ' 91' ' ' ILE . . . -72.73 -39.3 67.0 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.351 -0.843 . . . . 0.0 110.07 179.948 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.714 ' HG3' HD12 ' A' ' 61' ' ' LEU . 11.7 ttt-85 -69.08 -26.28 64.86 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.514 -0.741 . . . . 0.0 110.187 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 -76.08 -31.5 58.79 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.273 -0.892 . . . . 0.0 110.227 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.432 ' HB2' HG22 ' A' ' 94' ' ' VAL . 21.5 t -60.79 -56.3 22.81 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.371 -0.83 . . . . 0.0 110.173 179.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.71 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -55.31 -38.76 69.1 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.349 -0.844 . . . . 0.0 110.176 179.897 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.404 HD11 ' CZ ' ' A' ' 6' ' ' ARG . 84.8 mt -63.12 -31.95 73.22 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.374 -0.829 . . . . 0.0 110.178 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.1 tt0 -108.21 7.64 27.52 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.36 -0.837 . . . . 0.0 110.59 179.787 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.476 ' CE1' ' HG ' ' A' ' 86' ' ' LEU . 23.3 t-160 -103.86 32.35 3.97 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.171 -0.956 . . . . 0.0 109.92 179.838 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 29.0 ttp-105 -75.06 -24.81 58.27 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.473 -0.767 . . . . 0.0 110.465 -179.779 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -53.63 -35.74 61.28 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.194 -0.942 . . . . 0.0 110.379 -179.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -85.83 -51.59 6.31 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.404 -0.81 . . . . 0.0 110.038 179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.504 HD12 ' HB ' ' A' ' 20' ' ' ILE . 64.4 tp -57.44 -30.05 64.69 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.447 -0.783 . . . . 0.0 110.255 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -85.4 -33.16 22.03 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.435 -0.791 . . . . 0.0 110.371 -179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 44.9 tttp -67.5 -57.08 7.16 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.348 -0.845 . . . . 0.0 110.361 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 75.2 m-20 -81.76 -65.2 1.04 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.342 -0.849 . . . . 0.0 110.391 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.504 ' HB ' HD12 ' A' ' 16' ' ' LEU . 14.8 mm -79.27 162.4 3.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.287 -0.883 . . . . 0.0 110.18 -179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.571 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.9 mttt -156.28 141.2 17.18 Favored 'General case' 0 N--CA 1.491 1.624 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 179.912 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.603 HG21 ' HG2' ' A' ' 52' ' ' ARG . 62.8 p -24.97 96.2 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.411 0 O-C-N 121.692 -0.63 . . . . 0.0 110.849 -179.556 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.433 ' N ' ' O ' ' A' ' 21' ' ' LYS . 23.1 m -163.19 -175.96 4.57 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.617 -0.677 . . . . 0.0 110.304 -178.464 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.431 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.0 t80 -32.79 -40.56 0.05 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.831 -0.543 . . . . 0.0 112.176 -179.519 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.637 ' CG2' HD21 ' A' ' 75' ' ' LEU . 41.5 mm -57.3 -65.71 0.39 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.858 0 O-C-N 120.918 -1.114 . . . . 0.0 110.029 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.461 ' HE3' HD23 ' A' ' 56' ' ' LEU . 10.5 mtm -75.86 -37.4 58.99 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.385 -0.822 . . . . 0.0 110.073 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.616 ' HA ' HD12 ' A' ' 30' ' ' ILE . 4.5 t70 -57.88 -50.54 73.0 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.428 -0.795 . . . . 0.0 110.358 -179.884 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 38.4 t-80 -55.59 -37.87 68.67 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.317 -0.864 . . . . 0.0 110.101 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 4.7 mtp -63.23 -38.43 91.13 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.409 -0.807 . . . . 0.0 110.131 179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.616 HD12 ' HA ' ' A' ' 27' ' ' ASP . 93.7 mt -61.87 -36.61 74.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.393 -0.817 . . . . 0.0 110.029 179.921 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 59.4 m -92.83 -19.78 21.37 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.35 -0.844 . . . . 0.0 110.301 179.913 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -56.22 -24.78 44.3 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.312 -0.868 . . . . 0.0 110.301 179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.22 -12.34 3.82 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 110.077 -1.209 . . . . 0.0 110.077 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.674 ' C ' HD22 ' A' ' 35' ' ' LEU . 24.0 m-85 -67.53 -58.29 4.97 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.12 -1.224 . . . . 0.0 110.297 -179.85 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.674 HD22 ' C ' ' A' ' 34' ' ' PHE . 3.9 mm? -109.58 165.14 11.89 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.326 -0.859 . . . . 0.0 110.225 -179.733 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 42.8 p -65.14 163.56 14.77 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.328 -0.858 . . . . 0.0 110.079 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.1 mt -84.83 -27.87 6.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.284 -0.885 . . . . 0.0 110.177 -179.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 67.5 m -62.35 -25.45 67.91 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.357 -0.839 . . . . 0.0 110.261 179.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -70.49 -29.31 65.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.368 -0.833 . . . . 0.0 110.243 -179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -60.31 -53.89 52.19 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.326 -0.859 . . . . 0.0 110.25 179.972 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -59.63 -25.55 64.77 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.316 -0.865 . . . . 0.0 110.199 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.409 ' CG ' ' HG3' ' A' ' 46' ' ' GLU . 30.0 ttmt -76.46 -64.54 1.09 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.331 -0.856 . . . . 0.0 110.159 179.957 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.48 HG11 HD13 ' A' ' 56' ' ' LEU . 59.1 t -49.88 -33.65 8.98 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.493 -0.754 . . . . 0.0 110.699 -179.971 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 33.8 ttp180 -42.13 -38.9 1.82 Allowed 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.631 -0.668 . . . . 0.0 111.728 -179.251 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 9.5 t30 -145.26 21.82 1.54 Allowed 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.998 -1.064 . . . . 0.0 111.183 -179.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.445 ' N ' ' HD2' ' A' ' 47' ' ' PRO . 2.2 tm-20 -79.02 -55.62 0.92 Allowed Pre-proline 0 N--CA 1.493 1.713 0 O-C-N 120.993 -1.067 . . . . 0.0 110.423 179.834 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.445 ' HD2' ' N ' ' A' ' 46' ' ' GLU . 50.3 Cg_endo -75.67 170.05 21.01 Favored 'Trans proline' 0 C--N 1.313 -1.327 0 O-C-N 123.545 1.287 . . . . 0.0 110.553 -179.787 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 61.6 m -136.51 -40.07 0.64 Allowed 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.345 -0.847 . . . . 0.0 110.358 179.869 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -95.27 -161.76 0.89 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.339 -0.851 . . . . 0.0 110.311 -179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.6 pt20 -61.11 -16.63 46.26 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.367 -0.833 . . . . 0.0 110.64 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -56.7 -19.07 14.72 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.221 -0.924 . . . . 0.0 110.674 179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.603 ' HG2' HG21 ' A' ' 22' ' ' THR . 73.0 ttt180 -50.6 -64.95 0.65 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.266 -0.897 . . . . 0.0 110.65 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.472 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -61.98 -51.88 66.28 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.315 -0.866 . . . . 0.0 110.371 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -44.35 -46.37 9.31 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 121.483 -0.76 . . . . 0.0 111.091 -179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.6 tpt -67.01 -28.48 68.27 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.31 -0.869 . . . . 0.0 110.097 179.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.598 HD11 HD11 ' A' ' 30' ' ' ILE . 14.3 tp -81.93 -35.58 28.96 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.326 -0.859 . . . . 0.0 110.71 -179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.6 ' HA ' HD12 ' A' ' 60' ' ' ILE . 3.3 mm -60.49 -36.27 68.6 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.216 -0.927 . . . . 0.0 110.504 -179.539 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 16.1 mttp -70.1 -46.35 65.02 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.276 -0.89 . . . . 0.0 110.675 -179.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.438 ' N ' ' SD ' ' A' ' 59' ' ' MET . 0.3 OUTLIER -56.2 -24.92 44.96 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.166 -0.958 . . . . 0.0 110.652 179.795 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.6 HD12 ' HA ' ' A' ' 57' ' ' ILE . 95.3 mt -69.71 -57.48 8.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.229 -0.919 . . . . 0.0 109.68 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.714 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.9 mm? -78.06 -35.52 49.43 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.563 -0.711 . . . . 0.0 110.854 -179.591 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.73 -26.27 65.5 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.319 -0.863 . . . . 0.0 110.543 -179.608 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.7 -65.04 0.73 Allowed 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.289 -0.882 . . . . 0.0 110.314 -179.891 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -160.1 169.12 24.0 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.253 -0.904 . . . . 0.0 110.268 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 90.7 m-20 -82.92 -26.4 31.49 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.39 -0.819 . . . . 0.0 110.237 179.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -63.66 -39.48 94.45 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.316 -0.865 . . . . 0.0 110.24 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 12.1 t -60.54 -31.27 70.37 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.419 -0.801 . . . . 0.0 110.286 -179.928 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.436 ' CE2' HG12 ' A' ' 91' ' ' ILE . 1.9 t80 -62.99 -43.03 99.92 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.371 -0.831 . . . . 0.0 109.957 179.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 88.7 t -65.46 -37.15 79.37 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 121.358 -0.839 . . . . 0.0 109.913 179.76 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 16.0 t -67.47 -35.2 78.72 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.323 -0.861 . . . . 0.0 109.968 179.796 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.582 ' CE1' HD11 ' A' ' 75' ' ' LEU . 6.3 t80 -59.26 -29.9 67.89 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.41 -0.806 . . . . 0.0 109.8 179.72 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.523 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 37.7 t80 -70.35 -49.84 45.17 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.366 -0.834 . . . . 0.0 110.239 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 54.8 t30 -73.81 -29.36 62.12 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.341 -0.849 . . . . 0.0 110.452 -179.799 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -61.16 -35.31 76.77 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.339 -0.851 . . . . 0.0 110.281 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.637 HD21 ' CG2' ' A' ' 25' ' ' ILE . 21.3 mt -84.15 -36.37 22.93 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.376 -0.828 . . . . 0.0 110.28 179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.523 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 26.6 mt -67.43 -14.83 63.28 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.404 -0.81 . . . . 0.0 110.54 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 55.8 t-80 -54.35 -24.0 17.72 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.272 -0.892 . . . . 0.0 110.69 -179.82 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -112.64 -75.05 0.61 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.271 -0.893 . . . . 0.0 110.174 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.36 55.17 0.18 Allowed Glycine 0 N--CA 1.492 2.406 0 N-CA-C 109.455 -1.458 . . . . 0.0 109.455 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 33.7 m-85 -107.5 16.17 24.09 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -1.059 . . . . 0.0 110.575 -179.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.683 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 26.0 ttmt -47.35 -34.96 7.49 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.274 -0.891 . . . . 0.0 110.77 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.46 -48.99 36.51 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.362 -0.836 . . . . 0.0 109.86 179.681 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.427 ' O ' HD12 ' A' ' 87' ' ' LEU . 5.6 tt -69.37 -49.89 51.26 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.381 -0.825 . . . . 0.0 109.991 179.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -61.69 -28.33 69.33 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.461 -0.774 . . . . 0.0 110.171 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.683 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -59.83 -42.29 93.24 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.365 -0.835 . . . . 0.0 110.195 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.476 ' HG ' ' CE1' ' A' ' 12' ' ' HIS . 48.1 tp -65.39 -30.79 71.64 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.371 -0.831 . . . . 0.0 110.191 179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.504 HD22 ' CE2' ' A' ' 71' ' ' PHE . 1.1 mt -81.82 -27.89 33.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.399 -0.813 . . . . 0.0 110.109 179.908 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 16.7 t-80 -77.53 -45.97 23.81 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.421 -0.8 . . . . 0.0 110.284 -179.954 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -66.17 -19.96 65.99 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.355 -0.841 . . . . 0.0 110.328 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -81.01 -17.35 72.49 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 109.918 -1.273 . . . . 0.0 109.918 -179.967 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.568 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 27.8 mt -65.62 -54.67 28.4 Favored Pre-proline 0 N--CA 1.493 1.69 0 O-C-N 121.19 -1.183 . . . . 0.0 110.68 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.568 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 45.2 Cg_endo -71.08 -49.77 0.36 Allowed 'Trans proline' 0 C--N 1.314 -1.258 0 O-C-N 123.331 1.174 . . . . 0.0 110.684 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 57.9 t -117.5 140.83 38.87 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.683 0 O-C-N 121.303 -0.873 . . . . 0.0 110.192 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.432 HG22 ' HB2' ' A' ' 8' ' ' CYS . 58.0 t -119.35 -9.41 11.25 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.736 0 O-C-N 121.393 -0.817 . . . . 0.0 110.529 -179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 28.9 t -61.04 -69.27 0.24 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.218 -0.926 . . . . 0.0 110.263 -179.991 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 16.3 m -100.68 -40.76 7.21 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.351 -0.843 . . . . 0.0 110.196 -179.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 19.2 m . . . . . 0 N--CA 1.493 1.717 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.195 -179.941 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.605 0 CA-C-O 121.199 0.523 . . . . 0.0 110.253 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 48.7 p-10 -152.8 155.25 36.78 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.39 -0.819 . . . . 0.0 110.236 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.8 -24.84 67.92 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.323 -0.861 . . . . 0.0 110.296 -179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.8 ttpm? -58.76 -41.88 87.62 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.305 -0.872 . . . . 0.0 110.265 -179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.529 ' CB ' HG23 ' A' ' 91' ' ' ILE . . . -60.13 -40.91 91.42 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.34 -0.85 . . . . 0.0 110.087 179.904 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 21.8 ttt85 -64.15 -39.51 94.16 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.381 -0.825 . . . . 0.0 110.013 179.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 23.8 m120 -70.76 -27.55 64.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.405 -0.809 . . . . 0.0 110.032 179.82 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 6.5 t -62.08 -59.42 5.1 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.398 -0.814 . . . . 0.0 110.149 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.801 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.8 OUTLIER -52.51 -35.68 53.65 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.311 -0.868 . . . . 0.0 109.987 179.732 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 47.5 mt -80.75 -21.52 40.99 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.36 -0.837 . . . . 0.0 110.53 179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 36.8 tt0 -115.45 24.57 11.49 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.923 . . . . 0.0 110.483 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.422 ' CE1' ' CB ' ' A' ' 15' ' ' ALA . 8.2 t-80 -130.95 34.07 4.11 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.303 -0.873 . . . . 0.0 110.12 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 25.4 ttp-105 -71.27 -25.17 62.34 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.363 -0.836 . . . . 0.0 110.256 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -58.14 -34.14 69.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.238 -0.914 . . . . 0.0 110.158 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.422 ' CB ' ' CE1' ' A' ' 12' ' ' HIS . . . -77.95 -44.56 26.5 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.431 -0.793 . . . . 0.0 110.038 179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.696 HD22 HG12 ' A' ' 57' ' ' ILE . 3.5 tp -65.28 -38.68 91.03 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.308 -0.87 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.5 tt0 -56.58 -42.99 79.61 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.324 -0.86 . . . . 0.0 110.12 179.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.2 tttp -81.75 -24.31 36.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.367 -0.833 . . . . 0.0 110.028 179.761 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -81.16 -64.86 1.1 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.285 -0.884 . . . . 0.0 110.179 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.916 HD13 HG13 ' A' ' 25' ' ' ILE . 19.9 mt -128.59 163.17 33.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.353 -0.842 . . . . 0.0 110.404 179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.56 ' O ' ' C ' ' A' ' 22' ' ' THR . 9.2 mttt -125.48 142.41 51.52 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.616 -0.677 . . . . 0.0 109.383 179.792 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.571 HG23 ' HB2' ' A' ' 53' ' ' ALA . 66.7 p -24.05 98.37 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.333 0 CA-C-O 121.549 0.69 . . . . 0.0 111.075 -179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.423 ' O ' ' C ' ' A' ' 24' ' ' TYR . 40.0 m -155.85 -175.81 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.678 -0.638 . . . . 0.0 110.036 -178.609 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.423 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -33.01 -36.47 0.02 OUTLIER 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.895 -0.503 . . . . 0.0 112.039 -179.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.916 HG13 HD13 ' A' ' 20' ' ' ILE . 42.9 mm -54.61 -65.17 0.37 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 120.99 -1.069 . . . . 0.0 110.221 179.994 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.496 ' HE1' HG13 ' A' ' 57' ' ' ILE . 0.4 OUTLIER -75.41 -35.85 60.94 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.349 -0.845 . . . . 0.0 110.436 -179.86 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -62.18 -48.96 77.73 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.34 -0.85 . . . . 0.0 110.564 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 21.8 t-160 -55.86 -40.5 73.0 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.224 -0.923 . . . . 0.0 110.509 -179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.409 ' O ' ' CD1' ' A' ' 34' ' ' PHE . 0.0 OUTLIER -61.36 -50.27 73.57 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.328 -0.858 . . . . 0.0 110.237 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.953 HG23 ' HB2' ' A' ' 35' ' ' LEU . 21.1 mt -58.97 -25.52 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 O-C-N 121.392 -0.817 . . . . 0.0 110.418 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.3 m -96.89 -14.69 21.63 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.355 -0.841 . . . . 0.0 110.573 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 26.5 t0 -74.98 -3.0 29.75 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.238 -0.914 . . . . 0.0 110.771 179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 122.15 8.17 7.36 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.939 -1.264 . . . . 0.0 109.939 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.66 ' C ' HD22 ' A' ' 35' ' ' LEU . 19.2 m-85 -80.38 -70.36 0.53 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.115 -1.227 . . . . 0.0 110.376 179.892 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.953 ' HB2' HG23 ' A' ' 30' ' ' ILE . 3.9 mm? -108.67 164.64 12.19 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.387 -0.82 . . . . 0.0 110.04 -179.935 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 32.4 p -60.83 158.66 12.56 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.324 -0.86 . . . . 0.0 110.146 179.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 48.7 mm -73.91 -28.15 23.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.364 -0.835 . . . . 0.0 110.136 -179.946 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 3.7 m -59.96 -30.19 68.93 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.197 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 32.9 tt0 -70.31 -26.85 63.97 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.387 -0.821 . . . . 0.0 110.212 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 14.4 tt0 -68.39 -35.18 77.3 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.33 -0.856 . . . . 0.0 110.156 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -69.91 -30.63 68.1 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.388 -0.82 . . . . 0.0 110.075 179.925 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -66.62 -63.5 1.06 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 110.131 179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.402 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 65.0 t -47.14 -33.56 2.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.944 0 O-C-N 121.45 -0.781 . . . . 0.0 110.644 179.895 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 2.4 ttt85 -46.55 -47.55 19.64 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.54 -0.725 . . . . 0.0 111.369 -179.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 16.4 t-20 -145.07 13.98 1.47 Allowed 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.064 -1.022 . . . . 0.0 111.309 -179.607 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.64 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 15.6 tp10 -80.59 -47.64 1.23 Allowed Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 121.043 -1.036 . . . . 0.0 110.974 179.977 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.64 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.7 Cg_endo -76.45 169.95 20.9 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.128 1.067 . . . . 0.0 110.294 -179.901 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 31.1 m -141.13 -46.8 0.39 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.372 -0.83 . . . . 0.0 110.169 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -84.76 -160.2 0.47 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.288 -0.882 . . . . 0.0 110.175 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.44 -7.55 50.39 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.26 -0.9 . . . . 0.0 110.453 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 43.0 tt0 -61.39 -17.12 52.59 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.157 -0.964 . . . . 0.0 110.447 179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.472 ' HG2' HG21 ' A' ' 22' ' ' THR . 74.5 ttt180 -50.22 -59.61 3.78 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.244 -0.91 . . . . 0.0 110.387 -179.949 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.651 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -66.08 -48.06 72.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.347 -0.846 . . . . 0.0 110.001 179.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -49.25 -34.07 14.24 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.421 -0.799 . . . . 0.0 110.487 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 5.9 ttt -79.55 -25.14 41.73 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.429 -0.794 . . . . 0.0 109.974 179.625 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.831 HD11 ' CD1' ' A' ' 30' ' ' ILE . 14.0 tp -79.16 -49.18 12.98 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.336 -0.853 . . . . 0.0 110.105 -179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.696 HG12 HD22 ' A' ' 16' ' ' LEU . 2.5 mp -56.8 -30.9 34.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.318 -0.864 . . . . 0.0 109.997 179.923 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 36.3 mtpt -75.15 -43.36 52.89 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.345 -0.847 . . . . 0.0 110.191 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 17.3 mmt -58.46 -30.96 67.35 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.419 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.621 HD12 ' HA ' ' A' ' 57' ' ' ILE . 81.7 mt -68.18 -58.0 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.226 -0.921 . . . . 0.0 110.02 179.936 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.422 HD21 ' HG ' ' A' ' 9' ' ' LEU . 1.5 mm? -68.66 -40.34 80.23 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.375 -0.828 . . . . 0.0 110.502 -179.74 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 5.3 mmmt -55.58 -24.97 35.7 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.309 -0.869 . . . . 0.0 110.572 -179.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.97 -63.95 0.96 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.277 -0.89 . . . . 0.0 110.263 -179.979 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -160.07 167.97 26.62 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.295 -0.878 . . . . 0.0 110.272 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.0 m120 -76.61 -36.46 57.46 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.17 179.895 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -61.37 -28.49 69.27 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.332 -0.855 . . . . 0.0 110.124 179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.427 ' HG ' ' HE2' ' A' ' 34' ' ' PHE . 2.1 t -59.82 -48.58 81.11 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.38 -0.825 . . . . 0.0 110.139 179.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.801 ' CE1' HD23 ' A' ' 9' ' ' LEU . 4.0 t80 -57.71 -32.35 67.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.414 -0.804 . . . . 0.0 110.179 179.978 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.3 t -69.57 -44.09 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.333 -0.855 . . . . 0.0 109.939 179.693 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 23.4 t -65.51 -32.66 74.39 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.388 -0.82 . . . . 0.0 110.002 179.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.464 ' CE1' HD13 ' A' ' 87' ' ' LEU . 2.6 t80 -55.66 -41.54 73.79 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.339 -0.851 . . . . 0.0 109.857 179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.74 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 38.4 t80 -62.71 -43.28 99.21 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.31 -0.869 . . . . 0.0 110.112 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 12.9 t30 -70.49 -24.83 62.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.383 -0.823 . . . . 0.0 110.404 -179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.88 -52.33 37.73 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.26 -0.9 . . . . 0.0 110.326 -179.818 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 9.1 mt -62.72 -38.54 90.9 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.345 -0.847 . . . . 0.0 110.264 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.74 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 34.1 mt -66.91 -15.17 63.49 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.398 -0.814 . . . . 0.0 110.457 -179.845 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 3.8 t60 -62.25 -22.93 66.37 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.25 -0.906 . . . . 0.0 110.478 -179.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -108.69 -75.17 0.64 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.205 -0.935 . . . . 0.0 110.374 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.53 36.9 0.11 Allowed Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.762 ' CE2' HD11 ' A' ' 20' ' ' ILE . 28.5 m-85 -92.9 16.38 12.71 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.493 -1.004 . . . . 0.0 110.441 -179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.632 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 21.8 tttp -42.4 -30.83 0.36 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.413 -0.804 . . . . 0.0 111.034 -179.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 63.4 m-20 -78.83 -48.86 13.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.314 -0.866 . . . . 0.0 109.913 179.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.656 ' C ' HD13 ' A' ' 83' ' ' LEU . 2.7 tm? -72.71 -48.59 37.54 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.423 -0.798 . . . . 0.0 110.013 179.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.52 -34.71 72.97 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.387 -0.82 . . . . 0.0 110.139 179.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.632 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.3 -36.1 77.12 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.358 -0.839 . . . . 0.0 110.082 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 39.3 tp -61.88 -40.32 95.01 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.302 -0.874 . . . . 0.0 110.327 179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.464 HD13 ' CE1' ' A' ' 71' ' ' PHE . 1.1 mt -74.95 -30.04 61.1 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.359 -0.838 . . . . 0.0 110.276 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.457 ' HA ' HD12 ' A' ' 91' ' ' ILE . 5.6 t60 -84.97 -27.03 26.77 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.342 -0.849 . . . . 0.0 110.472 -179.765 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -79.75 -23.19 42.42 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.318 -0.864 . . . . 0.0 110.31 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -80.41 -24.96 58.02 Favored Glycine 0 N--CA 1.492 2.399 0 N-CA-C 109.784 -1.326 . . . . 0.0 109.784 -179.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.569 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.5 mt -59.63 -56.08 39.4 Favored Pre-proline 0 N--CA 1.493 1.685 0 O-C-N 121.189 -1.183 . . . . 0.0 110.45 -179.884 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.569 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo -70.82 -81.37 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.307 0 O-C-N 123.274 1.144 . . . . 0.0 110.705 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.483 HG12 ' N ' ' A' ' 94' ' ' VAL . 67.5 t -70.92 166.67 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.181 -0.949 . . . . 0.0 110.08 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.483 ' N ' HG12 ' A' ' 93' ' ' VAL . 59.0 t -99.64 -56.52 5.14 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.359 -0.838 . . . . 0.0 110.134 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 9.9 t -124.67 -69.66 0.79 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.29 -0.881 . . . . 0.0 110.304 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -130.98 -53.89 1.05 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.318 -0.864 . . . . 0.0 110.302 -179.943 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 12.0 p . . . . . 0 N--CA 1.492 1.657 0 CA-C-O 117.958 -1.02 . . . . 0.0 110.19 -179.95 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 5.2 ttm . . . . . 0 N--CA 1.49 1.567 0 CA-C-O 121.23 0.538 . . . . 0.0 110.274 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 3.2 p30 -68.25 161.76 26.52 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.413 -0.805 . . . . 0.0 110.102 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.86 -24.98 58.67 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.401 -0.812 . . . . 0.0 110.414 -179.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.3 ttmm -59.99 -34.98 74.05 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.349 -0.844 . . . . 0.0 110.552 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -59.24 -39.43 82.75 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.234 -0.916 . . . . 0.0 110.139 -179.938 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.449 ' O ' HD12 ' A' ' 10' ' ' LEU . 56.0 ttp180 -64.77 -31.75 73.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.333 -0.854 . . . . 0.0 109.997 179.706 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -74.88 -27.65 60.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.427 -0.796 . . . . 0.0 109.818 179.593 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 17.4 t -62.01 -50.65 71.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.431 -0.793 . . . . 0.0 110.115 179.871 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.674 ' O ' HD13 ' A' ' 9' ' ' LEU . 2.1 tm? -59.38 -38.48 80.62 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.35 -0.844 . . . . 0.0 109.871 179.862 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 6' ' ' ARG . 12.0 mt -72.5 -30.69 64.73 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.334 -0.854 . . . . 0.0 110.147 179.603 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 -81.97 -4.66 57.19 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.348 -0.845 . . . . 0.0 110.639 -179.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.862 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 9.7 t-160 -96.38 34.01 1.69 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.233 -0.917 . . . . 0.0 110.25 179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 6.6 ttt-85 -75.8 -41.57 52.43 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.846 -179.733 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -82.28 -35.67 27.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.208 -0.933 . . . . 0.0 110.953 -179.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.862 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -75.13 -25.85 58.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.077 -1.015 . . . . 0.0 110.267 -179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.576 HD11 ' CE ' ' A' ' 26' ' ' MET . 7.1 tt -85.28 -29.28 24.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.87 . . . . 0.0 109.831 179.673 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.9 tt0 -61.69 -38.19 86.93 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.423 -0.798 . . . . 0.0 110.084 179.805 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 13.8 ttmt -84.34 -31.54 24.74 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 110.345 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -84.46 -65.54 1.0 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.312 -0.867 . . . . 0.0 110.364 -179.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.534 HD12 HG13 ' A' ' 25' ' ' ILE . 15.2 mm -108.99 109.56 28.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.388 -0.82 . . . . 0.0 110.224 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.559 ' O ' ' C ' ' A' ' 22' ' ' THR . 34.3 mtpt -100.56 141.4 33.47 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.509 -0.744 . . . . 0.0 109.438 179.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.689 HG22 HD22 ' A' ' 56' ' ' LEU . 73.2 p -25.02 97.79 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.302 0 CA-C-O 121.49 0.662 . . . . 0.0 111.122 -179.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.433 ' O ' ' C ' ' A' ' 24' ' ' TYR . 7.8 t -160.34 -176.25 5.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.473 -0.767 . . . . 0.0 110.285 -178.667 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.444 ' CD1' ' HB2' ' A' ' 28' ' ' HIS . 9.2 t80 -33.28 -39.25 0.05 OUTLIER 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.859 -0.526 . . . . 0.0 111.866 -179.656 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.534 HG13 HD12 ' A' ' 20' ' ' ILE . 46.2 mm -57.74 -64.1 0.58 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.044 -1.035 . . . . 0.0 110.029 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.748 ' HB3' HD21 ' A' ' 56' ' ' LEU . 7.5 mmt -75.23 -34.36 61.42 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.323 -0.861 . . . . 0.0 110.198 179.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -63.9 -59.38 4.59 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.456 -0.777 . . . . 0.0 110.402 -179.919 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 0.444 ' HB2' ' CD1' ' A' ' 24' ' ' TYR . 11.4 t-80 -54.52 -24.92 22.75 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.329 -0.857 . . . . 0.0 110.474 -179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.41 ' O ' ' CD2' ' A' ' 34' ' ' PHE . 33.8 mtt -72.41 -38.58 68.35 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.246 -0.909 . . . . 0.0 110.348 179.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.732 HD11 HD11 ' A' ' 56' ' ' LEU . 82.5 mt -61.39 -50.18 81.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.248 -0.908 . . . . 0.0 110.049 179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 58.8 m -74.76 -15.57 60.76 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.383 -0.823 . . . . 0.0 110.455 -179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -56.45 -25.49 50.84 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.276 -0.89 . . . . 0.0 110.431 -179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 139.45 -13.72 3.22 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 110.042 -1.223 . . . . 0.0 110.042 179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.484 ' CB ' HD12 ' A' ' 35' ' ' LEU . 17.4 m-30 -58.56 -61.83 2.31 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.14 -1.212 . . . . 0.0 110.44 -179.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.708 HD22 ' OE1' ' A' ' 39' ' ' GLU . 3.9 mp -125.46 165.19 18.89 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.264 -0.897 . . . . 0.0 110.423 -179.865 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 26.3 p -57.23 173.53 0.24 Allowed 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.446 -0.784 . . . . 0.0 110.397 -179.829 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.544 ' H ' HD12 ' A' ' 37' ' ' ILE . 4.3 mp -85.35 -21.44 7.82 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.424 -0.797 . . . . 0.0 110.201 179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 4.9 m -57.91 -27.21 63.12 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.279 -0.888 . . . . 0.0 110.315 -179.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.708 ' OE1' HD22 ' A' ' 35' ' ' LEU . 38.3 tt0 -62.04 -39.92 93.97 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.391 -0.818 . . . . 0.0 110.149 179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -62.12 -32.26 72.81 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.361 -0.837 . . . . 0.0 110.114 -179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 14.2 tt0 -70.84 -32.13 69.06 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.391 -0.818 . . . . 0.0 110.167 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -75.58 -54.94 6.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.388 -0.82 . . . . 0.0 110.06 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 60.6 t -53.36 -33.85 21.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.848 0 O-C-N 121.379 -0.826 . . . . 0.0 110.47 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 16.8 ttt85 -46.7 -36.57 7.29 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.378 -0.826 . . . . 0.0 110.878 -179.722 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m120 -144.17 20.8 1.75 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.282 -0.886 . . . . 0.0 110.543 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.522 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 9.7 tt0 -81.91 -57.02 0.53 Allowed Pre-proline 0 N--CA 1.492 1.67 0 O-C-N 121.279 -0.888 . . . . 0.0 110.741 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.522 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 46.7 Cg_endo -72.49 170.09 20.19 Favored 'Trans proline' 0 C--N 1.313 -1.326 0 O-C-N 123.307 1.162 . . . . 0.0 110.631 -179.771 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 27.0 m -140.79 -43.03 0.39 Allowed 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.436 -0.79 . . . . 0.0 110.1 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 79.6 mm-40 -98.33 -154.35 0.46 Allowed 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.443 -0.786 . . . . 0.0 110.055 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -66.61 -12.55 58.53 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.281 -0.887 . . . . 0.0 110.609 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 6.9 tt0 -57.47 -19.29 23.27 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.246 -0.909 . . . . 0.0 110.778 -179.848 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.612 ' HG2' HG21 ' A' ' 22' ' ' THR . 2.1 ttt85 -51.62 -36.41 45.76 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.275 -0.89 . . . . 0.0 110.715 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.423 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -85.98 -18.0 33.79 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.234 -0.916 . . . . 0.0 110.528 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -83.34 -34.49 25.63 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.179 -0.95 . . . . 0.0 110.287 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 0.473 ' HG2' ' HE1' ' A' ' 59' ' ' MET . 0.7 OUTLIER -77.52 -47.78 18.69 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.342 -0.849 . . . . 0.0 110.427 -179.666 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.748 HD21 ' HB3' ' A' ' 26' ' ' MET . 17.7 tp -55.76 -40.76 73.04 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.355 -0.84 . . . . 0.0 110.548 -179.834 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.655 ' HA ' HD12 ' A' ' 60' ' ' ILE . 0.9 OUTLIER -67.88 -26.4 34.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.337 -0.852 . . . . 0.0 109.957 179.885 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 5.3 mtmm -70.9 -48.76 51.92 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.233 -0.917 . . . . 0.0 109.924 179.627 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 0.473 ' HE1' ' HG2' ' A' ' 55' ' ' MET . 0.0 OUTLIER -52.77 -30.52 33.39 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.295 -0.878 . . . . 0.0 110.447 179.899 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.655 HD12 ' HA ' ' A' ' 57' ' ' ILE . 85.1 mt -63.88 -53.01 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.329 -0.857 . . . . 0.0 109.873 179.712 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.516 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.7 mm? -82.17 -27.31 32.75 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.458 -0.776 . . . . 0.0 110.699 -179.659 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -60.74 -29.59 69.48 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.385 -0.822 . . . . 0.0 110.529 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -76.01 -65.07 0.96 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.24 -0.913 . . . . 0.0 110.389 -179.827 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -160.28 169.99 22.05 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.291 -0.881 . . . . 0.0 110.218 -179.943 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 27.8 m120 -80.58 -21.68 41.44 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.37 -0.831 . . . . 0.0 110.312 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 38.8 m-20 -61.06 -39.37 89.59 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.18 -0.95 . . . . 0.0 110.232 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 41.4 t -60.11 -28.41 67.82 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.333 -0.854 . . . . 0.0 110.139 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.585 ' HE1' HD23 ' A' ' 9' ' ' LEU . 16.2 t80 -70.4 -35.83 73.7 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.419 -0.801 . . . . 0.0 109.954 179.86 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 61.8 t -70.59 -41.68 77.93 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.334 -0.854 . . . . 0.0 110.118 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 41.3 t -63.73 -36.84 85.19 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.299 -0.876 . . . . 0.0 110.182 179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.574 ' CE1' HD22 ' A' ' 87' ' ' LEU . 5.9 t80 -57.05 -38.3 73.05 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.398 -0.814 . . . . 0.0 110.175 179.814 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.677 ' CE1' ' HB1' ' A' ' 84' ' ' ALA . 35.2 t80 -64.23 -43.33 95.29 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.341 -0.849 . . . . 0.0 110.372 -179.849 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -76.84 -25.4 53.14 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.366 -0.834 . . . . 0.0 110.477 -179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.19 -35.84 80.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.284 -0.885 . . . . 0.0 110.45 -179.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.536 HD11 ' CE2' ' A' ' 71' ' ' PHE . 11.6 mt -80.22 -40.98 26.02 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.278 -0.889 . . . . 0.0 110.356 -179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.607 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 39.2 mt -66.58 -14.97 63.07 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.712 -179.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 25.3 t-80 -63.71 -22.78 67.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.244 -0.91 . . . . 0.0 110.547 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.4 mt-10 -109.91 -75.27 0.63 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.207 -0.933 . . . . 0.0 110.459 -179.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.04 37.0 0.1 Allowed Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.345 -1.502 . . . . 0.0 109.345 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 38.1 m-85 -94.45 16.47 15.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.506 -0.996 . . . . 0.0 110.588 -179.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.604 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 38.5 ttpt -41.49 -32.39 0.33 Allowed 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.483 -0.761 . . . . 0.0 110.929 -179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 58.7 m-20 -67.35 -47.42 70.49 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.344 -0.848 . . . . 0.0 109.63 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.537 HD13 ' O ' ' A' ' 83' ' ' LEU . 1.1 tm? -69.94 -51.42 32.97 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.47 -0.769 . . . . 0.0 109.829 179.592 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.677 ' HB1' ' CE1' ' A' ' 72' ' ' TYR . . . -60.26 -30.04 69.18 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.44 -0.787 . . . . 0.0 110.202 179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.604 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -58.83 -41.35 86.68 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.32 -0.863 . . . . 0.0 110.124 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -61.42 -43.0 99.62 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.356 -0.84 . . . . 0.0 110.173 179.934 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.574 HD22 ' CE1' ' A' ' 71' ' ' PHE . 1.0 OUTLIER -70.34 -34.48 72.7 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.318 -0.864 . . . . 0.0 110.214 179.947 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.455 ' HA ' HD12 ' A' ' 91' ' ' ILE . 13.9 t-80 -77.87 -16.63 58.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.348 -0.845 . . . . 0.0 110.493 -179.989 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 3.3 m-20 -85.15 -14.97 45.33 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.293 -0.879 . . . . 0.0 110.545 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -109.58 -22.82 6.53 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.901 -1.279 . . . . 0.0 109.901 -179.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.568 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 19.3 mt -59.93 -57.39 27.12 Favored Pre-proline 0 N--CA 1.493 1.71 0 O-C-N 121.198 -1.177 . . . . 0.0 110.437 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.568 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.2 Cg_endo -70.83 -85.0 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.322 0 O-C-N 123.267 1.14 . . . . 0.0 110.564 179.75 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.47 HG12 ' N ' ' A' ' 94' ' ' VAL . 62.6 t -140.06 167.3 19.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.104 -0.998 . . . . 0.0 109.96 179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.47 ' N ' HG12 ' A' ' 93' ' ' VAL . 62.1 t -116.19 -25.9 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.287 -0.883 . . . . 0.0 110.354 -179.995 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 27.8 t -81.44 -71.61 0.47 Allowed 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.332 -0.855 . . . . 0.0 110.266 -179.873 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 74.3 p -60.51 -38.73 85.29 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.328 -0.857 . . . . 0.0 110.282 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 43.5 t . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.182 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mtm . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.184 0.516 . . . . 0.0 110.211 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 0.457 ' OD2' ' HB3' ' A' ' 5' ' ' ALA . 36.8 p-10 -104.23 104.77 14.73 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.309 -0.869 . . . . 0.0 110.398 179.988 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -74.94 -37.65 61.94 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.348 -0.845 . . . . 0.0 110.271 -179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 59.9 tttt -58.16 -41.02 82.92 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.381 -0.824 . . . . 0.0 110.301 -179.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.457 ' HB3' ' OD2' ' A' ' 2' ' ' ASP . . . -68.0 -41.18 82.65 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.335 -0.853 . . . . 0.0 110.091 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 15.6 ttt-85 -66.82 -32.87 74.43 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.365 -0.834 . . . . 0.0 110.07 179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -75.23 -27.78 59.64 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.344 -0.848 . . . . 0.0 110.283 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 37.3 t -60.68 -58.35 8.84 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.261 -0.899 . . . . 0.0 110.111 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.757 ' O ' HD13 ' A' ' 9' ' ' LEU . 0.9 OUTLIER -57.58 -34.71 69.5 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.379 -0.826 . . . . 0.0 110.046 179.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 85.1 mt -81.27 -21.2 39.56 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.343 -0.848 . . . . 0.0 110.471 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -116.66 53.67 0.88 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.306 -0.871 . . . . 0.0 110.427 -179.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.491 ' CE1' ' HB3' ' A' ' 15' ' ' ALA . 4.5 t-160 -159.78 42.37 0.21 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.333 -0.854 . . . . 0.0 109.772 179.792 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.533 ' CD ' ' HB2' ' A' ' 54' ' ' ALA . 0.1 OUTLIER -75.15 -33.78 61.55 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.474 -0.766 . . . . 0.0 110.565 -179.745 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.1 tt0 -58.99 -35.49 73.31 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.217 -0.927 . . . . 0.0 110.23 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.491 ' HB3' ' CE1' ' A' ' 12' ' ' HIS . . . -85.43 -34.98 21.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.433 -0.792 . . . . 0.0 110.141 179.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.631 ' C ' HD13 ' A' ' 16' ' ' LEU . 3.0 tm? -64.1 -46.41 84.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.387 -0.821 . . . . 0.0 109.871 -179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -61.65 -43.52 98.7 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.3 -0.875 . . . . 0.0 110.492 -179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 46.4 tttt -66.11 -42.29 89.41 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.362 -0.836 . . . . 0.0 110.524 -179.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.569 ' CG ' HD23 ' A' ' 83' ' ' LEU . 19.9 m-20 -80.28 -64.87 1.09 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.398 -0.814 . . . . 0.0 110.277 -179.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.774 HD12 HG13 ' A' ' 25' ' ' ILE . 24.9 mm -102.79 166.26 2.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.313 -0.867 . . . . 0.0 110.203 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.536 ' O ' ' C ' ' A' ' 22' ' ' THR . 38.9 mtmt -153.64 141.14 19.8 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.46 -0.775 . . . . 0.0 109.531 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.571 HG21 ' HG2' ' A' ' 52' ' ' ARG . 70.7 p -25.85 94.65 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.319 0 CA-C-O 121.455 0.645 . . . . 0.0 111.175 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.448 ' N ' ' O ' ' A' ' 21' ' ' LYS . 26.5 m -165.23 -175.85 3.82 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.632 -0.667 . . . . 0.0 109.923 -178.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.44 ' C ' ' O ' ' A' ' 23' ' ' SER . 7.9 t80 -33.66 -34.72 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.883 -0.511 . . . . 0.0 111.841 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.774 HG13 HD12 ' A' ' 20' ' ' ILE . 44.2 mm -53.49 -65.46 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.794 0 O-C-N 121.063 -1.023 . . . . 0.0 110.027 179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.63 ' HE1' HD11 ' A' ' 16' ' ' LEU . 0.7 OUTLIER -75.78 -37.9 58.78 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.23 -0.918 . . . . 0.0 110.216 179.55 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -57.65 -50.37 73.39 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -58.7 -33.17 69.88 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.247 -0.908 . . . . 0.0 110.075 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 5.0 mtt -68.41 -58.08 4.88 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.512 -0.742 . . . . 0.0 110.008 179.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.75 HG23 ' HB2' ' A' ' 35' ' ' LEU . 8.3 mt -56.47 -27.33 24.59 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 O-C-N 121.392 -0.817 . . . . 0.0 110.07 179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 33.5 m -88.67 -22.62 23.32 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.344 -0.847 . . . . 0.0 110.261 179.838 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -59.76 -26.82 66.01 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.328 -0.858 . . . . 0.0 110.33 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.64 -15.2 2.91 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.546 ' CB ' HD12 ' A' ' 35' ' ' LEU . 25.0 m-85 -57.82 -47.67 81.95 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.203 -1.175 . . . . 0.0 110.35 -179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.75 ' HB2' HG23 ' A' ' 30' ' ' ILE . 4.7 mp -132.07 165.13 24.7 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.347 -0.845 . . . . 0.0 110.387 -179.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 63.5 p -70.43 171.85 9.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.39 -0.819 . . . . 0.0 110.265 -179.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 49.4 mm -84.96 -18.77 9.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.824 . . . . 0.0 110.35 -179.946 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 21.0 m -55.79 -26.25 45.21 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.24 -0.912 . . . . 0.0 110.342 -179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.423 ' O ' HG23 ' A' ' 43' ' ' VAL . 26.9 tt0 -73.64 -28.03 61.57 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.425 -0.797 . . . . 0.0 110.196 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 18.7 tp10 -71.56 -41.69 68.75 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.363 -0.835 . . . . 0.0 110.246 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -64.15 -27.69 69.25 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.32 -0.862 . . . . 0.0 110.303 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.4 tttm -80.19 -60.98 2.12 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.173 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.423 HG23 ' O ' ' A' ' 39' ' ' GLU . 65.3 t -48.41 -33.85 4.82 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.88 0 O-C-N 121.442 -0.787 . . . . 0.0 110.668 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.5 ttt85 -46.62 -42.72 16.61 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.464 -0.772 . . . . 0.0 111.173 -179.608 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -145.22 17.25 1.54 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.114 -0.991 . . . . 0.0 110.974 -179.768 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.63 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.1 OUTLIER -79.55 -47.66 1.5 Allowed Pre-proline 0 N--CA 1.493 1.7 0 O-C-N 121.048 -1.033 . . . . 0.0 110.721 179.872 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.63 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.8 Cg_endo -77.13 170.08 20.31 Favored 'Trans proline' 0 C--N 1.316 -1.16 0 O-C-N 123.262 1.138 . . . . 0.0 110.334 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.8 m -129.25 -41.46 1.4 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.386 -0.821 . . . . 0.0 110.355 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 75.2 mm-40 -98.41 -159.61 0.75 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.355 -0.84 . . . . 0.0 110.363 -179.807 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 pt20 -65.74 -12.13 51.35 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.369 -0.832 . . . . 0.0 110.715 -179.862 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 15.4 tt0 -55.63 -20.03 12.43 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.152 -0.967 . . . . 0.0 110.678 179.952 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.571 ' HG2' HG21 ' A' ' 22' ' ' THR . 24.3 ttp180 -49.65 -37.43 28.28 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 121.177 -0.952 . . . . 0.0 110.592 -179.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.771 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -79.1 -53.04 7.4 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.367 -0.833 . . . . 0.0 110.113 179.844 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.533 ' HB2' ' CD ' ' A' ' 13' ' ' ARG . . . -50.45 -26.47 5.12 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.44 -0.788 . . . . 0.0 110.619 -179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.8 tpt -82.99 -28.04 29.98 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.318 -0.864 . . . . 0.0 110.241 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.447 HD11 HD13 ' A' ' 30' ' ' ILE . 14.0 tp -84.89 -50.85 7.17 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.771 HD12 ' O ' ' A' ' 53' ' ' ALA . 2.7 mp -58.93 -36.66 62.83 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.328 -0.858 . . . . 0.0 110.072 -179.908 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 2.5 mttp -66.56 -37.53 85.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.323 -0.861 . . . . 0.0 109.929 179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 7.7 mmt -61.27 -27.79 68.71 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.413 -0.804 . . . . 0.0 110.14 179.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.689 HD12 ' HA ' ' A' ' 57' ' ' ILE . 87.0 mt -66.72 -53.62 33.27 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.656 0 O-C-N 121.354 -0.841 . . . . 0.0 109.889 179.787 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.423 ' CD2' ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -77.47 -34.06 54.45 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.51 -0.744 . . . . 0.0 110.535 -179.771 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.27 -25.08 67.5 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.279 -0.888 . . . . 0.0 110.339 -179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -77.35 -64.51 1.12 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.286 -0.884 . . . . 0.0 110.355 -179.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 11.1 p-10 -153.6 166.49 32.59 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.388 -0.82 . . . . 0.0 110.371 -179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 6.1 m120 -85.21 -25.33 27.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.419 -0.8 . . . . 0.0 110.246 179.914 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.48 -35.25 71.9 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.338 -0.851 . . . . 0.0 110.382 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 45.8 t -64.45 -34.07 77.36 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.354 -0.841 . . . . 0.0 110.127 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.609 ' HE1' HD23 ' A' ' 9' ' ' LEU . 18.5 t80 -60.58 -44.89 95.71 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.4 -0.812 . . . . 0.0 110.023 179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.15 -34.29 68.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.326 -0.859 . . . . 0.0 109.804 179.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 17.8 t -73.58 -29.43 62.4 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.41 -0.806 . . . . 0.0 109.978 179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.612 ' CE2' HD11 ' A' ' 75' ' ' LEU . 10.4 t80 -57.47 -44.54 84.93 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.499 -0.751 . . . . 0.0 109.771 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.583 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 46.3 t80 -61.05 -45.79 93.34 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.459 -0.776 . . . . 0.0 110.072 179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 65.0 t30 -76.42 -23.58 53.99 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.351 -0.843 . . . . 0.0 110.577 -179.886 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -69.89 -32.01 70.12 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.268 -0.895 . . . . 0.0 110.302 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.612 HD11 ' CE2' ' A' ' 71' ' ' PHE . 3.9 mt -84.9 -39.23 18.47 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.367 -0.833 . . . . 0.0 110.204 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.583 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 23.0 mt -67.2 -14.73 63.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.408 -0.808 . . . . 0.0 110.524 -179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 18.7 t-160 -56.78 -24.75 52.65 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.282 -0.886 . . . . 0.0 110.643 -179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -116.78 -75.08 0.58 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.167 -0.958 . . . . 0.0 110.394 -179.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -171.37 67.35 0.14 Allowed Glycine 0 N--CA 1.493 2.462 0 N-CA-C 109.426 -1.469 . . . . 0.0 109.426 -179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 21.7 m-85 -125.08 16.37 8.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.406 -1.056 . . . . 0.0 110.509 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.3 ttmt -44.34 -30.93 0.91 Allowed 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.473 -0.767 . . . . 0.0 110.96 -179.754 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -66.61 -49.12 67.34 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.355 -0.841 . . . . 0.0 109.791 179.609 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.659 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.1 tm? -78.84 -40.49 32.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.427 -0.795 . . . . 0.0 109.798 179.723 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.438 ' HB3' HD21 ' A' ' 76' ' ' LEU . . . -60.37 -45.91 91.83 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.409 -0.807 . . . . 0.0 110.183 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -62.1 -29.21 70.16 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.334 -0.854 . . . . 0.0 110.07 179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.429 HD12 ' HA ' ' A' ' 86' ' ' LEU . 23.2 tp -59.99 -50.19 74.72 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.446 -0.783 . . . . 0.0 110.212 179.931 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . . . . . . . . . 2.9 mp -77.4 -25.3 50.68 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.298 -0.876 . . . . 0.0 110.258 -179.953 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.472 ' HA ' HD12 ' A' ' 91' ' ' ILE . 2.0 t60 -68.74 -41.11 79.42 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.303 -0.873 . . . . 0.0 110.359 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 70.3 m-20 -68.62 -22.19 64.44 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.259 -0.901 . . . . 0.0 110.543 -179.917 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -84.9 -19.71 59.03 Favored Glycine 0 N--CA 1.493 2.459 0 N-CA-C 109.987 -1.245 . . . . 0.0 109.987 -179.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.566 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 26.8 mt -60.67 -53.91 59.83 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.171 -1.193 . . . . 0.0 110.576 -179.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.566 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.4 Cg_endo -71.26 -88.66 0.0 OUTLIER 'Trans proline' 0 C--N 1.313 -1.317 0 O-C-N 123.271 1.143 . . . . 0.0 110.547 179.904 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.598 HG12 ' H ' ' A' ' 95' ' ' SER . 48.5 t -145.84 147.75 18.06 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.169 -0.957 . . . . 0.0 109.92 179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 63.1 t -78.29 -26.37 14.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.737 0 O-C-N 121.412 -0.805 . . . . 0.0 110.292 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.598 ' H ' HG12 ' A' ' 93' ' ' VAL . 6.1 t -98.62 -15.99 19.25 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.264 -0.897 . . . . 0.0 110.715 -179.795 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -110.54 5.08 20.92 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.146 -0.972 . . . . 0.0 110.81 -179.966 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 11.6 p . . . . . 0 N--CA 1.493 1.713 0 O-C-N 121.069 -1.019 . . . . 0.0 110.164 179.997 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.658 0 CA-C-O 121.209 0.528 . . . . 0.0 110.241 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -133.9 107.61 7.94 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.391 -0.818 . . . . 0.0 110.118 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.21 -24.95 57.83 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.317 -0.864 . . . . 0.0 110.458 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -55.08 -34.64 63.78 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.283 -0.886 . . . . 0.0 110.379 -179.789 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.56 -39.04 92.38 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.215 -0.928 . . . . 0.0 109.886 179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 20.1 ttm180 -63.8 -30.24 71.36 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.388 -0.82 . . . . 0.0 109.851 179.648 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 45.8 m-80 -72.82 -37.14 67.59 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.493 -0.754 . . . . 0.0 109.959 179.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 21.8 t -63.27 -50.18 71.15 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.374 -0.829 . . . . 0.0 110.156 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.759 ' O ' HD13 ' A' ' 9' ' ' LEU . 1.5 tm? -60.18 -36.58 77.92 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.277 -0.889 . . . . 0.0 109.913 179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.9 mt -68.23 -31.04 70.25 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.339 -0.85 . . . . 0.0 109.961 179.599 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.8 tt0 -97.07 22.9 7.86 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.403 -0.81 . . . . 0.0 110.16 179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.664 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 6.8 t60 -107.97 23.25 14.77 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.264 -0.898 . . . . 0.0 110.331 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.584 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 49.1 ttp180 -67.94 -47.5 68.53 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.232 -0.917 . . . . 0.0 110.003 179.889 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.71 -35.38 77.88 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.362 -0.836 . . . . 0.0 110.111 179.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.664 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -78.81 -43.87 24.37 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.399 -0.813 . . . . 0.0 110.074 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.898 HD21 ' CE ' ' A' ' 26' ' ' MET . 2.3 tm? -59.09 -50.36 74.36 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.296 -0.878 . . . . 0.0 109.692 -179.875 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -58.91 -54.07 51.25 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.335 -0.853 . . . . 0.0 110.225 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 26.5 tttt -61.84 -27.55 68.86 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.29 -0.881 . . . . 0.0 110.167 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.697 ' HB3' HD11 ' A' ' 83' ' ' LEU . 63.6 m-20 -85.1 -65.19 1.04 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.41 -0.806 . . . . 0.0 110.317 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.905 HD13 HG13 ' A' ' 25' ' ' ILE . 22.1 mt -134.38 147.12 30.16 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.307 -0.87 . . . . 0.0 110.336 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.58 ' O ' ' C ' ' A' ' 22' ' ' THR . 0.8 OUTLIER -106.44 141.98 36.85 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.562 -0.711 . . . . 0.0 109.298 179.458 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.58 ' C ' ' O ' ' A' ' 21' ' ' LYS . 81.8 p -24.17 98.49 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.493 0.663 . . . . 0.0 110.891 -179.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.425 ' O ' ' C ' ' A' ' 24' ' ' TYR . 3.3 m -152.22 -175.68 5.36 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.69 -0.631 . . . . 0.0 110.183 -178.51 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.425 ' C ' ' O ' ' A' ' 23' ' ' SER . 10.4 t80 -32.91 -37.43 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.896 -0.503 . . . . 0.0 112.064 -179.792 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.905 HG13 HD13 ' A' ' 20' ' ' ILE . 44.3 mm -52.45 -65.25 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.901 -1.125 . . . . 0.0 110.169 -179.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.898 ' CE ' HD21 ' A' ' 16' ' ' LEU . 2.1 mpt? -75.16 -50.49 16.11 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.275 -0.891 . . . . 0.0 110.392 179.832 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 19.4 t70 -47.44 -51.53 19.86 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.526 -0.734 . . . . 0.0 111.228 -179.585 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -55.26 -40.09 70.56 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.193 -0.942 . . . . 0.0 110.181 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.419 ' HE1' ' HB2' ' A' ' 71' ' ' PHE . 42.9 mtp -68.11 -32.52 72.87 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.398 -0.814 . . . . 0.0 110.433 179.861 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.492 HG23 ' HB2' ' A' ' 35' ' ' LEU . 39.7 mm -61.94 -65.43 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.34 -0.85 . . . . 0.0 110.405 -179.822 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 16.2 m -59.94 -19.27 51.0 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.426 -0.796 . . . . 0.0 110.691 -179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -56.5 -22.37 32.29 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.18 -0.95 . . . . 0.0 110.407 180.0 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.86 -14.53 3.35 Favored Glycine 0 N--CA 1.492 2.387 0 N-CA-C 109.844 -1.302 . . . . 0.0 109.844 -179.982 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.722 ' C ' HD22 ' A' ' 35' ' ' LEU . 15.0 m-30 -60.91 -67.76 0.37 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.177 -1.19 . . . . 0.0 110.441 -179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.722 HD22 ' C ' ' A' ' 34' ' ' PHE . 3.8 mm? -113.25 150.05 32.94 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.313 -0.867 . . . . 0.0 110.251 -179.699 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 77.8 p -62.58 175.18 0.83 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.393 -0.817 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.561 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.7 mp -77.68 -15.64 14.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.715 0 O-C-N 121.426 -0.797 . . . . 0.0 110.497 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 6.3 m -61.77 -31.25 71.43 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.236 -0.915 . . . . 0.0 110.415 -179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 44.7 tt0 -70.92 -31.05 67.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.329 -0.857 . . . . 0.0 110.274 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -75.16 -27.67 59.81 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.34 -0.85 . . . . 0.0 110.433 -179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.5 tt0 -68.76 -35.53 77.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.183 -0.948 . . . . 0.0 110.362 -179.83 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 5.9 ttmt -77.7 -59.75 2.65 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.228 -0.92 . . . . 0.0 110.265 -179.966 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.423 ' HA ' ' HD3' ' A' ' 47' ' ' PRO . 78.8 t -47.42 -33.44 2.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.894 0 O-C-N 121.406 -0.809 . . . . 0.0 110.593 179.888 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 31.6 ttp180 -46.67 -53.17 12.22 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.588 -0.695 . . . . 0.0 111.505 -179.532 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.6 t-20 -137.82 4.75 2.57 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.05 -1.031 . . . . 0.0 111.645 -179.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.578 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 8.9 tp10 -75.2 -47.49 4.49 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 120.917 -1.115 . . . . 0.0 110.884 179.987 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.578 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.0 Cg_endo -74.84 169.99 21.36 Favored 'Trans proline' 0 C--N 1.316 -1.144 0 O-C-N 123.189 1.099 . . . . 0.0 110.455 -179.906 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -152.65 -50.37 0.1 Allowed 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.376 -0.827 . . . . 0.0 110.103 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -80.05 -160.71 0.3 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.379 -0.826 . . . . 0.0 110.076 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -66.76 -13.82 61.87 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.417 -0.802 . . . . 0.0 110.501 179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -62.76 -16.29 57.18 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.236 -0.915 . . . . 0.0 110.494 -179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 12.5 ttt180 -51.82 -60.66 2.91 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.249 -0.907 . . . . 0.0 110.518 -179.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.437 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -72.7 -48.37 39.44 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.324 -0.86 . . . . 0.0 110.299 -179.848 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.584 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -46.76 -35.53 6.27 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.434 -0.791 . . . . 0.0 110.781 -179.811 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -82.05 -25.02 34.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.364 -0.835 . . . . 0.0 109.932 179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.412 HD23 HG22 ' A' ' 22' ' ' THR . 32.3 tp -80.17 -39.4 29.38 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.311 -0.868 . . . . 0.0 110.23 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.544 ' HA ' HD12 ' A' ' 60' ' ' ILE . 32.7 mm -63.37 -38.74 82.97 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 O-C-N 121.354 -0.841 . . . . 0.0 109.933 179.809 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -64.74 -38.12 89.93 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.42 -0.8 . . . . 0.0 109.74 179.728 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 25.7 mmt -59.43 -27.81 66.38 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.404 -0.81 . . . . 0.0 110.012 179.726 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.544 HD12 ' HA ' ' A' ' 57' ' ' ILE . 91.5 mt -66.99 -49.81 70.26 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.515 -0.741 . . . . 0.0 109.959 179.856 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.415 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.5 mm? -80.69 -29.21 36.54 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.475 -0.766 . . . . 0.0 110.635 -179.714 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 13.9 mmtt -61.28 -28.92 69.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.317 -0.864 . . . . 0.0 110.451 -179.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.58 -65.27 0.74 Allowed 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.386 -0.821 . . . . 0.0 110.249 -179.925 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -160.24 170.1 21.85 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.397 -0.815 . . . . 0.0 110.187 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -81.31 -28.87 34.41 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.382 -0.824 . . . . 0.0 110.133 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 76.6 m-20 -61.69 -36.85 82.08 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.351 -0.843 . . . . 0.0 110.251 -179.951 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 6.7 t -59.8 -37.46 79.18 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.385 -0.822 . . . . 0.0 110.246 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.658 ' CE1' HD23 ' A' ' 9' ' ' LEU . 11.6 t80 -60.31 -36.29 77.56 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.328 -0.857 . . . . 0.0 109.862 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 57.7 t -65.23 -35.58 75.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.42 -0.8 . . . . 0.0 109.856 179.615 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 15.1 t -69.58 -37.11 76.83 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.401 -0.812 . . . . 0.0 110.046 179.722 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.789 ' CE1' HD11 ' A' ' 75' ' ' LEU . 21.5 t80 -52.41 -39.67 61.21 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.429 -0.795 . . . . 0.0 109.918 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.751 ' CD1' ' HB1' ' A' ' 84' ' ' ALA . 47.2 t80 -62.46 -51.95 65.48 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.463 -0.773 . . . . 0.0 109.996 179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -72.68 -20.6 61.21 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.324 -0.86 . . . . 0.0 110.562 -179.913 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -67.78 -41.28 83.49 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.26 -0.9 . . . . 0.0 110.368 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.789 HD11 ' CE1' ' A' ' 71' ' ' PHE . 2.1 mt -80.03 -35.72 36.85 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.326 -0.858 . . . . 0.0 110.196 -179.92 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.542 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 32.2 mt -65.0 -15.55 62.42 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.391 -0.818 . . . . 0.0 110.389 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -58.19 -21.36 47.2 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.203 -0.935 . . . . 0.0 110.467 179.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.7 mt-10 -116.96 -75.05 0.58 Allowed 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.337 -0.852 . . . . 0.0 110.288 -179.984 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.59 67.74 0.12 Allowed Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 -179.875 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.443 ' CZ ' HD11 ' A' ' 20' ' ' ILE . 12.3 m-85 -125.14 16.39 8.44 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.409 -1.053 . . . . 0.0 110.565 -179.795 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.633 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 67.3 tttt -45.0 -37.55 4.12 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.319 -0.863 . . . . 0.0 110.814 -179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -67.64 -44.54 77.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.279 -0.888 . . . . 0.0 109.734 179.639 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.697 HD11 ' HB3' ' A' ' 19' ' ' ASP . 4.2 tt -70.24 -53.88 15.12 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.454 -0.779 . . . . 0.0 109.796 179.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.751 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -60.75 -26.58 67.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.431 -0.793 . . . . 0.0 110.322 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.633 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.36 -43.93 96.06 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.346 -0.846 . . . . 0.0 110.154 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.708 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -61.54 -43.13 99.42 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.363 -0.835 . . . . 0.0 109.852 179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.472 HD12 ' O ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -73.33 -34.16 65.52 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.401 -0.812 . . . . 0.0 110.296 179.905 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.59 ' HA ' HD12 ' A' ' 91' ' ' ILE . 54.3 t-80 -70.01 -48.1 59.47 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.415 -0.803 . . . . 0.0 110.168 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.62 -18.93 61.48 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.361 -0.837 . . . . 0.0 110.405 -179.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.45 -21.81 53.02 Favored Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.887 -1.285 . . . . 0.0 109.887 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.613 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 57.3 mt -59.26 -52.55 73.66 Favored Pre-proline 0 N--CA 1.493 1.714 0 O-C-N 121.223 -1.163 . . . . 0.0 110.594 -179.851 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.613 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.9 Cg_endo -72.12 -81.9 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.293 0 O-C-N 123.328 1.173 . . . . 0.0 110.755 179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.411 HG23 ' C ' ' A' ' 92' ' ' PRO . 59.4 t -146.06 141.82 21.5 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.066 -1.021 . . . . 0.0 110.13 -179.922 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 62.3 t -94.28 -25.23 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.717 0 O-C-N 121.347 -0.845 . . . . 0.0 110.163 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 7.8 t -58.81 -25.71 63.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.303 -0.873 . . . . 0.0 110.387 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -114.61 5.07 15.31 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.305 -0.872 . . . . 0.0 110.633 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 117.932 -1.032 . . . . 0.0 110.236 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 121.189 0.519 . . . . 0.0 110.157 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -138.53 149.84 45.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.311 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.5 -24.6 56.88 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.381 -0.824 . . . . 0.0 110.325 179.876 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.5 ttmt -51.08 -39.15 55.37 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.348 -0.845 . . . . 0.0 110.784 -179.718 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -64.12 -41.23 97.32 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.291 -0.881 . . . . 0.0 110.242 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 42.0 ttt180 -67.39 -30.63 70.46 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.313 -0.867 . . . . 0.0 110.052 179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 77.8 m-20 -72.07 -27.43 62.68 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.375 -0.828 . . . . 0.0 110.062 179.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 46.0 t -63.21 -56.5 16.15 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.426 -0.796 . . . . 0.0 109.956 179.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.749 ' O ' HD13 ' A' ' 9' ' ' LEU . 1.1 tm? -62.06 -34.8 76.94 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.414 -0.804 . . . . 0.0 109.777 179.844 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 58.5 mt -65.79 -33.67 76.4 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.34 -0.85 . . . . 0.0 110.014 179.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 25.6 tt0 -94.04 18.9 9.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.333 -0.854 . . . . 0.0 110.267 179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.412 ' CD2' ' O ' ' A' ' 12' ' ' HIS . 52.0 t60 -103.45 26.24 8.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.924 . . . . 0.0 110.055 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.531 ' CD ' ' HB1' ' A' ' 54' ' ' ALA . 61.4 ttp180 -75.07 -50.47 16.33 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.413 -0.804 . . . . 0.0 110.063 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -58.94 -33.78 70.99 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.379 -0.826 . . . . 0.0 110.307 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -76.11 -46.97 26.25 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.359 -0.838 . . . . 0.0 110.058 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.594 ' C ' HD13 ' A' ' 16' ' ' LEU . 3.4 tm? -57.44 -41.55 80.71 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.396 -0.815 . . . . 0.0 110.185 -179.99 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.32 -45.4 76.33 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.34 -0.85 . . . . 0.0 110.454 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 2.1 ttmp? -85.2 -23.42 28.32 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.27 -0.893 . . . . 0.0 110.495 -179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.584 ' HB3' HD11 ' A' ' 83' ' ' LEU . 6.2 m-20 -74.11 -65.24 0.87 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.303 -0.873 . . . . 0.0 110.419 -179.707 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.698 HD13 HG13 ' A' ' 25' ' ' ILE . 24.1 mt -146.9 143.35 20.39 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.322 -0.862 . . . . 0.0 110.558 -179.947 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.57 ' O ' ' C ' ' A' ' 22' ' ' THR . 8.4 mttt -94.78 142.57 27.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.589 -0.695 . . . . 0.0 109.162 179.127 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.57 ' C ' ' O ' ' A' ' 21' ' ' LYS . 80.9 p -23.5 97.58 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.438 0 O-C-N 121.618 -0.676 . . . . 0.0 110.921 -179.168 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.432 ' O ' ' C ' ' A' ' 24' ' ' TYR . 26.2 t -146.32 -176.02 5.0 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.628 -0.67 . . . . 0.0 110.38 -178.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.432 ' C ' ' O ' ' A' ' 23' ' ' SER . 13.8 t80 -33.15 -37.98 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.046 0 O-C-N 121.963 -0.46 . . . . 0.0 111.941 -179.727 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.698 HG13 HD13 ' A' ' 20' ' ' ILE . 45.3 mm -57.5 -65.56 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.822 0 O-C-N 120.99 -1.069 . . . . 0.0 109.859 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.457 ' CE ' HD12 ' A' ' 57' ' ' ILE . 11.4 mmt -75.73 -25.27 56.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.459 -0.776 . . . . 0.0 110.323 179.648 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -71.15 -54.51 10.77 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.414 -0.804 . . . . 0.0 110.412 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 74.7 t60 -55.88 -32.62 63.86 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.292 -0.88 . . . . 0.0 110.378 -179.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 16.8 mtp -62.48 -44.31 96.69 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.337 -0.852 . . . . 0.0 110.326 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.555 HG21 ' HB2' ' A' ' 40' ' ' GLU . 69.6 mt -63.82 -40.66 89.87 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 O-C-N 121.397 -0.814 . . . . 0.0 110.199 -179.863 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 66.4 m -79.53 -25.12 41.78 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.34 -0.85 . . . . 0.0 110.328 -179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 27.0 t70 -58.96 -20.72 55.05 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.242 -0.911 . . . . 0.0 110.363 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 140.07 -13.48 3.07 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.906 -1.277 . . . . 0.0 109.906 -179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.672 ' C ' HD12 ' A' ' 35' ' ' LEU . 7.9 m-30 -54.17 -66.6 0.37 Allowed 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.207 -1.172 . . . . 0.0 110.4 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.672 HD12 ' C ' ' A' ' 34' ' ' PHE . 6.3 mp -128.34 165.19 21.05 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.358 -0.839 . . . . 0.0 110.212 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 18.7 p -56.31 154.4 8.23 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.399 -0.813 . . . . 0.0 110.396 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . 0.43 ' H ' HD12 ' A' ' 37' ' ' ILE . 3.2 mp -77.16 -23.66 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 O-C-N 121.405 -0.81 . . . . 0.0 110.32 -179.993 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 72.1 m -64.59 -37.34 87.23 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.384 -0.822 . . . . 0.0 110.169 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.478 ' OE1' HD23 ' A' ' 35' ' ' LEU . 38.0 tt0 -68.1 -25.58 65.39 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.383 -0.823 . . . . 0.0 110.257 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.555 ' HB2' HG21 ' A' ' 30' ' ' ILE . 1.7 tt0 -74.95 -31.88 61.61 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.302 -0.874 . . . . 0.0 110.412 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -67.76 -32.42 72.99 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.336 -0.853 . . . . 0.0 110.306 -179.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -69.23 -40.09 78.13 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.363 -0.835 . . . . 0.0 110.11 -179.953 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 1.005 HG11 HD13 ' A' ' 56' ' ' LEU . 83.9 t -59.36 -34.35 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.366 -0.834 . . . . 0.0 110.265 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 48.3 ttt180 -49.07 -30.75 6.79 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.502 -0.749 . . . . 0.0 111.04 -179.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.4 m-20 -145.2 20.25 1.57 Allowed 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.218 -0.926 . . . . 0.0 110.926 -179.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.546 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 10.3 tt0 -79.92 -57.24 0.69 Allowed Pre-proline 0 N--CA 1.493 1.695 0 O-C-N 121.096 -1.003 . . . . 0.0 110.355 179.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.546 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 47.7 Cg_endo -72.99 170.26 20.21 Favored 'Trans proline' 0 C--N 1.313 -1.315 0 O-C-N 123.347 1.183 . . . . 0.0 110.52 -179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 6.8 m -131.07 -41.8 1.11 Allowed 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.412 -0.805 . . . . 0.0 110.24 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -87.85 -162.38 0.81 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.362 -0.836 . . . . 0.0 110.224 179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 9.6 mp0 -71.46 -9.18 57.78 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.337 -0.852 . . . . 0.0 110.568 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 34.6 tt0 -60.25 -17.51 42.46 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 121.185 -0.947 . . . . 0.0 110.544 -179.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 40.3 ttp180 -50.94 -49.53 59.61 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.213 -0.929 . . . . 0.0 110.683 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.438 ' O ' HG12 ' A' ' 57' ' ' ILE . . . -67.79 -61.82 1.7 Allowed 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.269 -0.894 . . . . 0.0 110.512 -179.825 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.531 ' HB1' ' CD ' ' A' ' 13' ' ' ARG . . . -48.85 -39.6 26.3 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.498 -0.751 . . . . 0.0 111.036 -179.593 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 9.3 ttm -65.34 -45.2 85.18 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.228 -0.92 . . . . 0.0 110.415 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 1.005 HD13 HG11 ' A' ' 43' ' ' VAL . 14.8 tp -59.25 -34.84 72.7 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.362 -0.836 . . . . 0.0 110.714 -179.604 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.691 ' HA ' HD12 ' A' ' 60' ' ' ILE . 6.8 mm -61.19 -36.12 70.51 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.229 -0.919 . . . . 0.0 110.482 -179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -62.05 -45.52 93.2 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.176 -0.953 . . . . 0.0 110.043 179.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -54.41 -28.86 46.62 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.287 -0.883 . . . . 0.0 110.463 179.876 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.691 HD12 ' HA ' ' A' ' 57' ' ' ILE . 86.6 mt -65.82 -54.69 24.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.39 -0.819 . . . . 0.0 109.841 179.807 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.42 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.1 mm? -79.35 -30.31 42.59 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.468 -0.77 . . . . 0.0 110.715 -179.645 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -58.96 -25.01 63.16 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.284 -0.885 . . . . 0.0 110.611 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.64 ' HB2' HD11 ' A' ' 35' ' ' LEU . 11.4 tttt -72.61 -65.29 0.81 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.312 -0.868 . . . . 0.0 110.367 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.8 t0 -160.25 170.12 21.79 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.265 -0.897 . . . . 0.0 110.271 -179.975 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.5 m120 -75.47 -29.81 59.71 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.371 -0.831 . . . . 0.0 110.128 179.964 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 59.3 m-20 -62.84 -33.75 75.89 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.357 -0.839 . . . . 0.0 110.309 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 10.2 t -60.2 -26.85 66.69 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.37 -0.831 . . . . 0.0 110.159 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.718 ' HE1' HD23 ' A' ' 9' ' ' LEU . 13.8 t80 -75.86 -37.62 58.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.415 -0.803 . . . . 0.0 110.111 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.9 t -70.5 -37.02 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.269 -0.895 . . . . 0.0 110.164 179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 22.0 t -69.04 -37.66 78.69 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.324 -0.86 . . . . 0.0 110.279 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.479 ' HE2' HD22 ' A' ' 87' ' ' LEU . 5.8 t80 -54.99 -40.77 70.43 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.266 -0.896 . . . . 0.0 109.879 179.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.528 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 29.1 t80 -61.71 -38.94 89.74 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.308 -0.87 . . . . 0.0 109.947 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 23.1 t30 -78.27 -23.8 47.11 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.388 -0.82 . . . . 0.0 110.482 179.937 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.2 81.08 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.265 -0.897 . . . . 0.0 110.367 -179.935 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 32.0 mt -77.78 -37.33 49.17 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.344 -0.847 . . . . 0.0 110.114 -179.891 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.528 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 39.6 mt -65.84 -15.05 62.54 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.453 -0.78 . . . . 0.0 110.467 179.961 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -63.4 -31.85 73.12 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.249 -0.907 . . . . 0.0 110.659 -179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -100.75 -75.68 0.58 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.26 -0.9 . . . . 0.0 110.519 -179.656 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.26 35.31 0.1 Allowed Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.903 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 18.6 m-85 -94.71 16.01 16.81 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.445 -1.032 . . . . 0.0 110.484 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.481 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 26.9 tttt -47.79 -31.36 4.81 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.342 -0.849 . . . . 0.0 110.677 -179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -66.62 -54.47 23.04 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.405 -0.809 . . . . 0.0 109.807 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.584 HD11 ' HB3' ' A' ' 19' ' ' ASP . 5.6 tt -73.22 -41.19 64.02 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.411 -0.806 . . . . 0.0 109.928 179.736 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.89 -36.93 82.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.42 -0.8 . . . . 0.0 109.924 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.481 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -61.25 -35.18 76.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.389 -0.82 . . . . 0.0 110.126 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 4.6 tt -59.39 -42.22 91.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.331 -0.856 . . . . 0.0 110.23 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.479 HD22 ' HE2' ' A' ' 71' ' ' PHE . 0.9 OUTLIER -71.41 -42.81 67.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.409 -0.807 . . . . 0.0 110.232 -179.949 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.727 ' HA ' HD12 ' A' ' 91' ' ' ILE . 21.1 t60 -66.03 -32.92 74.67 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.385 -0.822 . . . . 0.0 110.305 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -67.19 -14.84 63.29 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.372 -0.83 . . . . 0.0 110.587 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -108.55 -3.73 32.59 Favored Glycine 0 N--CA 1.492 2.381 0 N-CA-C 110.234 -1.146 . . . . 0.0 110.234 -179.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.727 HD12 ' HA ' ' A' ' 88' ' ' HIS . 19.3 mt -67.49 -54.98 15.97 Favored Pre-proline 0 N--CA 1.492 1.66 0 O-C-N 121.046 -1.267 . . . . 0.0 110.375 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.542 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo -70.74 -83.15 0.01 OUTLIER 'Trans proline' 0 C--N 1.313 -1.329 0 O-C-N 123.319 1.168 . . . . 0.0 110.65 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.525 HG12 ' H ' ' A' ' 95' ' ' SER . 58.0 t -128.93 154.81 40.44 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.113 -0.992 . . . . 0.0 110.162 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 61.5 t -111.55 -10.66 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 110.581 -179.875 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.525 ' H ' HG12 ' A' ' 93' ' ' VAL . 26.9 t -56.37 -56.69 18.0 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.2 -0.937 . . . . 0.0 110.37 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 31.3 t -136.14 -69.64 0.48 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.345 -0.847 . . . . 0.0 110.282 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 9.1 m . . . . . 0 N--CA 1.493 1.69 0 CA-C-O 118.011 -0.995 . . . . 0.0 110.261 179.977 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 121.172 0.51 . . . . 0.0 110.186 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -115.73 149.08 39.02 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.391 -0.818 . . . . 0.0 110.194 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.86 -24.95 65.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.369 -0.832 . . . . 0.0 110.289 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.41 ' CE ' HG23 ' A' ' 94' ' ' VAL . 40.3 tttp -64.78 -43.93 91.65 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.39 -0.819 . . . . 0.0 110.291 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -58.43 -41.63 85.45 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.22 -0.925 . . . . 0.0 110.095 179.911 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 38.6 ttm-85 -62.53 -46.32 88.92 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.331 -0.856 . . . . 0.0 109.747 179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -64.96 -25.48 67.89 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.461 -0.775 . . . . 0.0 110.125 179.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 8.5 t -58.77 -59.28 5.67 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.294 -0.879 . . . . 0.0 110.149 179.879 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.805 HD23 ' CE1' ' A' ' 68' ' ' TYR . 0.9 OUTLIER -60.29 -38.49 83.77 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.383 -0.823 . . . . 0.0 109.82 179.633 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 28.9 mt -63.24 -29.33 70.68 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.322 -0.861 . . . . 0.0 109.723 179.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.3 tt0 -99.66 14.74 29.05 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.541 -0.725 . . . . 0.0 110.257 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.656 ' CD2' HD21 ' A' ' 87' ' ' LEU . 60.2 t60 -97.83 25.49 5.89 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.243 -0.91 . . . . 0.0 110.171 179.977 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 16.7 ttp-105 -72.31 -50.05 29.89 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.426 -0.796 . . . . 0.0 110.104 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 18.7 tt0 -63.13 -27.05 69.12 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.307 -0.871 . . . . 0.0 110.081 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -84.29 -45.48 12.79 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.321 -0.862 . . . . 0.0 110.322 -179.965 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.648 ' C ' HD13 ' A' ' 16' ' ' LEU . 2.8 tm? -64.32 -48.4 75.76 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.277 -0.889 . . . . 0.0 109.735 179.928 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 23.4 tt0 -64.58 -33.27 75.53 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.369 -0.832 . . . . 0.0 110.125 179.898 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 76.4 tttt -82.93 -27.32 30.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.344 -0.848 . . . . 0.0 110.123 179.926 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.669 ' HB3' HD11 ' A' ' 83' ' ' LEU . 57.2 m-20 -84.2 -63.65 1.3 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.371 -0.831 . . . . 0.0 110.145 179.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.666 HD13 HG13 ' A' ' 25' ' ' ILE . 27.3 mt -136.11 109.78 9.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.605 179.987 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.564 ' O ' ' C ' ' A' ' 22' ' ' THR . 6.6 mttt -62.15 142.69 57.48 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.353 -0.842 . . . . 0.0 109.241 178.661 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.772 HG21 ' HG2' ' A' ' 52' ' ' ARG . 11.7 p -23.62 97.64 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.338 0 CA-C-O 121.677 0.751 . . . . 0.0 111.29 -179.058 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.428 ' O ' ' C ' ' A' ' 24' ' ' TYR . 17.9 t -141.98 -176.28 4.73 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.665 -0.647 . . . . 0.0 110.316 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.428 ' C ' ' O ' ' A' ' 23' ' ' SER . 16.4 t80 -33.42 -38.05 0.04 OUTLIER 'General case' 0 N--CA 1.5 2.049 0 O-C-N 121.899 -0.5 . . . . 0.0 111.842 -179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.666 HG13 HD13 ' A' ' 20' ' ' ILE . 43.3 mm -58.87 -60.17 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.844 0 O-C-N 121.024 -1.047 . . . . 0.0 109.948 179.777 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.587 ' SD ' HD11 ' A' ' 60' ' ' ILE . 7.9 mmt -75.35 -28.04 59.43 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.324 -0.86 . . . . 0.0 110.233 179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -74.78 -60.46 2.27 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.324 -0.86 . . . . 0.0 110.51 -179.692 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 63.0 t-80 -58.35 -25.78 62.38 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.386 -0.821 . . . . 0.0 110.624 -179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 8.2 ttt -70.6 -49.56 46.43 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.31 -0.869 . . . . 0.0 110.389 -179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.828 HD11 HD11 ' A' ' 56' ' ' LEU . 69.2 mt -60.01 -31.24 47.31 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 O-C-N 121.304 -0.872 . . . . 0.0 110.152 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 24.7 m -77.91 -14.98 59.36 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.285 -0.884 . . . . 0.0 110.434 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 30.2 t70 -56.07 -25.44 45.24 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.219 -0.926 . . . . 0.0 110.468 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 137.16 -11.48 3.85 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 110.107 -1.197 . . . . 0.0 110.107 179.917 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.538 ' CB ' HD12 ' A' ' 35' ' ' LEU . 23.1 m-85 -58.43 -58.63 7.68 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.125 -1.22 . . . . 0.0 110.308 -179.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.606 ' HB2' HG23 ' A' ' 30' ' ' ILE . 5.3 mp -116.04 163.3 16.13 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.361 -0.837 . . . . 0.0 110.217 -179.879 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 8.5 p -59.74 148.16 35.23 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.378 -0.826 . . . . 0.0 110.41 -179.694 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 71.9 mt -69.75 -20.6 23.69 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 121.431 -0.793 . . . . 0.0 110.239 179.958 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 45.8 m -58.02 -27.35 63.46 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.306 -0.871 . . . . 0.0 110.28 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -67.14 -33.77 76.14 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.325 -0.86 . . . . 0.0 110.128 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 tt0 -59.81 -37.5 79.32 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.361 -0.837 . . . . 0.0 110.206 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -68.68 -30.22 68.84 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.347 -0.846 . . . . 0.0 110.101 179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 9.6 ttmt -76.42 -57.86 3.62 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.388 -0.82 . . . . 0.0 110.048 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 66.8 t -48.99 -33.92 5.88 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 O-C-N 121.409 -0.807 . . . . 0.0 110.647 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 1.5 ttm-85 -48.83 -40.93 31.22 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.456 -0.777 . . . . 0.0 111.312 -179.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 -145.22 18.59 1.56 Allowed 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.117 -0.989 . . . . 0.0 111.178 -179.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.626 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 0.4 OUTLIER -81.1 -48.49 1.07 Allowed Pre-proline 0 N--CA 1.493 1.698 0 O-C-N 121.021 -1.049 . . . . 0.0 110.71 -179.967 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.626 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.7 Cg_endo -77.0 170.15 20.32 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 O-C-N 123.182 1.096 . . . . 0.0 110.291 179.973 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 11.6 m -134.16 -46.52 0.77 Allowed 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.321 -0.862 . . . . 0.0 110.135 179.978 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 77.0 mm-40 -90.14 -155.34 0.37 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.331 -0.856 . . . . 0.0 110.09 -179.992 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 21.4 mp0 -76.38 -3.28 36.12 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.254 -0.904 . . . . 0.0 110.674 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -59.91 -17.56 38.35 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.129 -0.982 . . . . 0.0 110.553 179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.772 ' HG2' HG21 ' A' ' 22' ' ' THR . 69.2 ttt180 -51.55 -43.51 62.38 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.29 -0.881 . . . . 0.0 110.621 -179.92 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -87.23 -7.69 57.62 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.277 -0.89 . . . . 0.0 110.599 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.02 -45.01 12.54 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.07 -1.019 . . . . 0.0 110.021 179.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 15.0 tpp -76.44 -33.39 58.76 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.38 -0.825 . . . . 0.0 109.912 179.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.828 HD11 HD11 ' A' ' 30' ' ' ILE . 1.1 tm? -61.17 -44.07 97.88 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.445 -0.784 . . . . 0.0 109.878 179.844 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.551 ' CD1' ' N ' ' A' ' 57' ' ' ILE . 0.5 OUTLIER -64.17 -45.89 95.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.388 -0.82 . . . . 0.0 109.73 179.733 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.8 mttp -63.99 -36.27 83.41 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.298 -0.876 . . . . 0.0 109.855 179.614 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.8 mmt -59.84 -35.37 74.6 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.425 -0.797 . . . . 0.0 110.301 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.587 HD11 ' SD ' ' A' ' 26' ' ' MET . 96.7 mt -59.87 -52.77 57.19 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.765 0 O-C-N 121.401 -0.812 . . . . 0.0 110.121 179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -76.28 -36.23 58.51 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.334 -0.854 . . . . 0.0 110.705 -179.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.33 -25.5 59.45 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.247 -0.908 . . . . 0.0 110.606 -179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -84.98 -64.94 1.07 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.217 -0.927 . . . . 0.0 110.244 -179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -158.87 165.22 34.7 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.266 -0.896 . . . . 0.0 110.226 -179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -85.13 -22.09 28.99 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.481 -0.762 . . . . 0.0 110.318 -179.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 97.5 m-20 -56.48 -32.79 65.35 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 -179.875 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.403 ' HA ' ' CE1' ' A' ' 34' ' ' PHE . 21.7 t -73.14 -32.44 64.9 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.381 -0.824 . . . . 0.0 110.154 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.805 ' CE1' HD23 ' A' ' 9' ' ' LEU . 9.3 t80 -63.55 -46.46 85.84 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 60.0 t -65.02 -43.91 96.02 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.285 -0.885 . . . . 0.0 110.019 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 14.9 t -62.53 -36.37 82.39 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.363 -0.836 . . . . 0.0 110.111 179.892 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.426 ' CE1' HD11 ' A' ' 75' ' ' LEU . 5.9 t80 -53.58 -36.85 62.37 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.327 -0.858 . . . . 0.0 109.693 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.619 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.7 t80 -63.68 -43.27 97.16 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.436 -0.79 . . . . 0.0 109.827 179.63 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 10.2 t-20 -76.56 -27.45 55.88 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.391 -0.818 . . . . 0.0 110.375 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.66 -51.49 69.15 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.287 -0.883 . . . . 0.0 110.26 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.631 HD21 ' CG2' ' A' ' 25' ' ' ILE . 68.3 mt -65.7 -38.78 90.19 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.422 -0.799 . . . . 0.0 110.239 -179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.619 HD11 ' CE1' ' A' ' 72' ' ' TYR . 58.6 mt -67.01 -14.99 63.44 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.347 -0.845 . . . . 0.0 110.482 -179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 2.4 t60 -56.94 -25.08 57.05 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.219 -0.925 . . . . 0.0 110.479 -179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -112.68 -75.01 0.61 Allowed 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.314 -0.866 . . . . 0.0 110.375 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -172.71 60.43 0.15 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.447 -1.461 . . . . 0.0 109.447 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 30.4 m-85 -114.36 16.32 17.86 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.432 -1.04 . . . . 0.0 110.504 -179.816 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 17.8 ttpt -44.84 -30.05 0.91 Allowed 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.39 -0.818 . . . . 0.0 110.781 -179.737 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 43.5 m-20 -67.84 -60.24 2.67 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.319 -0.863 . . . . 0.0 109.732 179.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.689 HD23 ' O ' ' A' ' 83' ' ' LEU . 5.2 tt -69.77 -37.47 76.39 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.371 -0.831 . . . . 0.0 109.892 179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.471 ' CB ' HD21 ' A' ' 76' ' ' LEU . . . -62.09 -29.58 70.42 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.378 -0.826 . . . . 0.0 110.039 179.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -70.09 -33.15 71.51 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.431 -0.793 . . . . 0.0 110.014 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.62 HD13 ' O ' ' A' ' 86' ' ' LEU . 1.7 tm? -59.16 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.33 -0.857 . . . . 0.0 109.656 179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.656 HD21 ' CD2' ' A' ' 12' ' ' HIS . 1.1 mt -72.61 -37.96 67.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.39 -0.819 . . . . 0.0 110.176 179.821 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.451 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 21.6 t-160 -60.73 -51.03 71.08 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.407 -0.808 . . . . 0.0 110.258 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -59.55 -20.01 52.5 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.325 -0.859 . . . . 0.0 110.326 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.51 2.13 70.13 Favored Glycine 0 N--CA 1.49 2.242 0 N-CA-C 110.26 -1.136 . . . . 0.0 110.26 -179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.649 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 8.6 mm -76.87 -57.94 1.12 Allowed Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.027 -1.278 . . . . 0.0 110.142 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.649 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 44.5 Cg_endo -73.74 -82.33 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.256 0 O-C-N 123.207 1.109 . . . . 0.0 110.434 179.597 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.486 HG12 ' N ' ' A' ' 94' ' ' VAL . 59.8 t -147.37 167.68 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.066 -1.021 . . . . 0.0 109.862 179.924 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.486 ' N ' HG12 ' A' ' 93' ' ' VAL . 83.6 t -68.48 -63.43 0.95 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.291 -0.881 . . . . 0.0 109.973 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 26.5 t -159.76 -71.16 0.08 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.4 -0.813 . . . . 0.0 110.142 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 2.4 m -123.12 -46.89 2.05 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.433 -0.792 . . . . 0.0 110.188 179.945 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 117.997 -1.002 . . . . 0.0 110.196 -179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.494 1.726 0 CA-C-O 121.19 0.519 . . . . 0.0 110.139 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.8 p-10 -64.52 107.96 1.53 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.342 -0.849 . . . . 0.0 110.192 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -75.12 -24.58 58.07 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.314 -0.866 . . . . 0.0 110.309 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 5.5 ttmm -51.92 -33.61 38.0 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.291 -0.881 . . . . 0.0 110.71 -179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.403 ' HA ' ' HA ' ' A' ' 91' ' ' ILE . . . -67.63 -36.33 80.6 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.227 -0.92 . . . . 0.0 110.139 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.702 ' HG3' HD12 ' A' ' 61' ' ' LEU . 24.1 ttt180 -69.83 -30.34 67.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.399 -0.813 . . . . 0.0 109.969 179.924 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 0.504 ' HA ' HD12 ' A' ' 10' ' ' LEU . 92.6 m-20 -73.56 -28.92 62.11 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.394 -0.816 . . . . 0.0 110.172 -179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 48.9 t -62.56 -51.35 67.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.379 -0.826 . . . . 0.0 110.091 179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.803 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.8 tm? -60.36 -34.64 74.15 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.344 -0.847 . . . . 0.0 109.843 179.745 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.504 HD12 ' HA ' ' A' ' 7' ' ' ASN . 53.4 mt -62.6 -30.21 71.17 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.357 -0.839 . . . . 0.0 109.958 179.647 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 39.3 tt0 -91.58 13.16 18.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.365 -0.834 . . . . 0.0 110.457 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.433 ' CG ' HD21 ' A' ' 87' ' ' LEU . 42.7 t60 -96.02 22.34 7.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.283 -0.886 . . . . 0.0 110.2 179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 32.0 ttp85 -75.35 -57.54 3.83 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.259 -0.901 . . . . 0.0 110.452 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -59.19 -35.12 73.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.375 -0.828 . . . . 0.0 110.49 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -74.49 -49.7 21.15 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.344 -0.848 . . . . 0.0 110.166 179.96 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.663 HD13 ' CG1' ' A' ' 57' ' ' ILE . 7.8 tt -62.09 -32.44 72.99 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.404 -0.81 . . . . 0.0 110.255 179.92 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 43.2 tt0 -56.01 -52.06 65.54 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.425 -0.797 . . . . 0.0 110.384 -179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 23.3 tttt -85.07 -25.16 27.75 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.336 -0.853 . . . . 0.0 110.48 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.612 ' HB3' HD11 ' A' ' 83' ' ' LEU . 78.9 m-20 -85.35 -65.39 1.02 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.238 -0.914 . . . . 0.0 110.773 -179.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 8.9 mm -117.09 109.63 28.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.228 -0.92 . . . . 0.0 110.599 -179.588 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.552 ' O ' ' C ' ' A' ' 22' ' ' THR . 12.0 mttt -96.93 141.68 29.81 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.461 -0.774 . . . . 0.0 109.156 179.08 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.775 HG22 HD22 ' A' ' 56' ' ' LEU . 75.8 p -24.39 97.72 0.01 OUTLIER 'General case' 0 N--CA 1.505 2.292 0 O-C-N 121.681 -0.637 . . . . 0.0 111.202 -179.436 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.441 ' O ' ' C ' ' A' ' 24' ' ' TYR . 41.8 t -156.78 -176.72 6.13 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.603 -0.685 . . . . 0.0 110.357 -178.843 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.441 ' C ' ' O ' ' A' ' 23' ' ' SER . 14.8 t80 -33.63 -44.5 0.15 Allowed 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.875 -0.515 . . . . 0.0 111.775 -179.546 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 45.2 mm -56.57 -52.59 51.52 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 O-C-N 120.963 -1.086 . . . . 0.0 109.893 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 0.521 ' HB3' HD21 ' A' ' 56' ' ' LEU . 6.9 mmt -75.38 -47.13 28.93 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.454 -0.779 . . . . 0.0 110.306 179.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.42 -62.17 2.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.421 -0.8 . . . . 0.0 110.793 -179.552 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 67.1 t60 -53.01 -36.93 61.04 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.219 -0.926 . . . . 0.0 110.84 -179.553 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 0.435 ' HG2' ' CE2' ' A' ' 34' ' ' PHE . 20.9 ttp -66.61 -42.82 86.27 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.278 -0.889 . . . . 0.0 110.342 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.4 HG13 ' CE ' ' A' ' 29' ' ' MET . 67.5 mt -72.47 -47.31 52.39 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.733 0 O-C-N 121.288 -0.882 . . . . 0.0 110.183 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 68.4 m -63.04 -18.61 63.53 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.283 -0.886 . . . . 0.0 110.48 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 28.2 t70 -58.31 -20.04 39.76 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.193 -0.942 . . . . 0.0 110.535 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 131.75 -5.05 5.46 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 110.026 -1.23 . . . . 0.0 110.026 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.435 ' CE2' ' HG2' ' A' ' 29' ' ' MET . 7.4 m-30 -55.82 -54.89 39.04 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.136 -1.214 . . . . 0.0 110.395 -179.975 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.64 HD21 ' HB2' ' A' ' 63' ' ' LYS . 1.1 mp -129.07 165.11 21.83 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.365 -0.835 . . . . 0.0 110.077 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 12.9 p -56.85 145.17 30.5 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.378 -0.826 . . . . 0.0 110.492 -179.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 17.4 mt -61.76 -23.89 32.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.432 -0.792 . . . . 0.0 110.28 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 14.9 m -59.36 -26.3 64.95 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.265 -0.897 . . . . 0.0 110.371 -179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.02 -46.64 83.56 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.273 -0.892 . . . . 0.0 110.207 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -63.06 -32.43 73.8 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.398 -0.814 . . . . 0.0 110.157 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 28.2 tt0 -64.89 -27.53 68.92 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.359 -0.838 . . . . 0.0 110.141 179.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 1.8 ttmt -84.85 -59.68 2.28 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.389 -0.82 . . . . 0.0 110.33 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 1.02 HG11 HD13 ' A' ' 56' ' ' LEU . 58.4 t -48.14 -33.89 4.38 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.962 0 O-C-N 121.432 -0.793 . . . . 0.0 110.758 -179.914 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 22.3 ttm180 -47.82 -40.78 22.14 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.409 -0.807 . . . . 0.0 111.14 -179.634 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -145.2 18.27 1.56 Allowed 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.211 -0.931 . . . . 0.0 110.868 -179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.612 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.3 tm-20 -81.98 -48.16 0.95 Allowed Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.108 -0.995 . . . . 0.0 110.887 -179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.612 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 49.4 Cg_endo -76.05 169.94 21.1 Favored 'Trans proline' 0 C--N 1.315 -1.203 0 O-C-N 123.186 1.098 . . . . 0.0 110.359 179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 8.5 m -128.6 -40.09 1.6 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.386 -0.821 . . . . 0.0 110.345 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -104.93 -154.35 0.51 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.361 -0.837 . . . . 0.0 110.107 -179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -64.15 -12.59 41.31 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.25 -0.906 . . . . 0.0 110.83 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 24.0 tt0 -51.75 -24.52 5.98 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.114 -0.991 . . . . 0.0 110.686 -179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.447 ' CD ' HG21 ' A' ' 22' ' ' THR . 29.4 ttm180 -55.27 -40.13 70.64 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.26 -0.9 . . . . 0.0 110.322 -179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.47 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -81.08 -11.54 59.47 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -0.874 . . . . 0.0 110.469 179.991 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -85.43 -47.76 9.65 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.118 -0.988 . . . . 0.0 110.261 179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 2.5 ttt -71.81 -37.85 70.31 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.355 -0.84 . . . . 0.0 110.378 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 1.02 HD13 HG11 ' A' ' 43' ' ' VAL . 13.0 tp -60.36 -46.34 90.29 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.257 -0.902 . . . . 0.0 110.306 -179.902 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.663 ' CG1' HD13 ' A' ' 16' ' ' LEU . 1.3 mp -72.51 -39.12 61.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.837 . . . . 0.0 109.987 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 1.6 mttm -64.49 -37.29 87.02 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.258 -0.901 . . . . 0.0 109.712 179.578 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 4.4 mmt -60.36 -31.35 70.24 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.454 -0.779 . . . . 0.0 109.939 179.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.651 HD12 ' HA ' ' A' ' 57' ' ' ILE . 97.1 mt -60.77 -54.74 31.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.407 -0.808 . . . . 0.0 109.885 179.666 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.702 HD12 ' HG3' ' A' ' 6' ' ' ARG . 1.7 mm? -69.93 -27.69 64.97 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.474 -0.766 . . . . 0.0 110.601 -179.711 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -67.68 -29.09 68.28 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.244 -0.91 . . . . 0.0 110.342 -179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.64 ' HB2' HD21 ' A' ' 35' ' ' LEU . 1.3 tmtt? -72.74 -64.97 0.85 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.257 -0.902 . . . . 0.0 110.235 -179.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -160.09 166.7 29.35 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.391 -0.818 . . . . 0.0 110.182 179.99 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 55.9 m-80 -81.05 -25.5 37.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.442 -0.786 . . . . 0.0 110.137 179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -62.27 -34.01 75.74 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.383 -0.823 . . . . 0.0 110.13 179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.2 t -59.65 -37.93 80.06 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.376 -0.827 . . . . 0.0 110.012 179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.803 ' CE1' HD23 ' A' ' 9' ' ' LEU . 10.4 t80 -66.39 -34.3 77.65 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.485 -0.759 . . . . 0.0 109.84 179.803 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 58.6 t -72.69 -40.46 61.71 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.0 110.05 179.81 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 48.1 t -67.06 -43.45 82.66 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.436 -0.79 . . . . 0.0 110.022 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.726 ' CE1' HD11 ' A' ' 75' ' ' LEU . 1.1 t80 -55.15 -29.89 58.72 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.38 -0.825 . . . . 0.0 109.789 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.678 ' CZ ' HD11 ' A' ' 76' ' ' LEU . 26.9 t80 -67.57 -39.64 84.89 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.355 -0.841 . . . . 0.0 109.939 179.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 64.5 t30 -76.51 -34.52 58.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.414 -0.804 . . . . 0.0 110.308 -179.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -59.8 -31.98 70.2 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.336 -0.853 . . . . 0.0 110.33 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.726 HD11 ' CE1' ' A' ' 71' ' ' PHE . 36.9 mt -82.88 -37.35 24.4 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.313 -0.867 . . . . 0.0 110.279 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.678 HD11 ' CZ ' ' A' ' 72' ' ' TYR . 20.7 mt -70.13 -14.88 62.85 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.388 -0.82 . . . . 0.0 110.477 -179.864 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 6.3 t60 -70.49 -23.1 62.61 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.098 -1.001 . . . . 0.0 110.742 -179.664 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 12.7 mm-40 -106.26 -75.49 0.63 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.21 -0.931 . . . . 0.0 110.559 -179.758 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -175.31 35.98 0.1 Allowed Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.516 -1.434 . . . . 0.0 109.516 -179.901 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -100.46 16.04 25.91 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.502 -0.999 . . . . 0.0 110.51 -179.927 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.525 ' O ' ' HB2' ' A' ' 85' ' ' ALA . 45.4 tttt -46.75 -31.78 3.19 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.352 -0.843 . . . . 0.0 110.711 -179.751 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -67.07 -51.57 52.89 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.309 -0.87 . . . . 0.0 109.694 179.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.612 HD11 ' HB3' ' A' ' 19' ' ' ASP . 4.9 tt -71.14 -48.79 49.9 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 109.99 179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.43 ' HB1' ' CD1' ' A' ' 72' ' ' TYR . . . -57.9 -34.92 70.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.417 -0.802 . . . . 0.0 110.312 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.525 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -60.75 -36.02 77.85 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.364 -0.835 . . . . 0.0 110.029 -179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 0.421 HD23 ' C ' ' A' ' 86' ' ' LEU . 10.0 tt -62.43 -36.5 82.58 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.422 -0.799 . . . . 0.0 110.288 -179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.45 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.1 mt -80.83 -29.87 35.84 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.367 -0.833 . . . . 0.0 110.351 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.873 ' HA ' HD12 ' A' ' 91' ' ' ILE . 57.1 t-80 -75.31 -55.21 5.93 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.393 -0.817 . . . . 0.0 110.494 -179.784 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -60.16 -19.13 52.42 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.289 -0.882 . . . . 0.0 110.588 -179.793 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -85.86 -22.82 48.2 Favored Glycine 0 N--CA 1.492 2.377 0 N-CA-C 110.032 -1.227 . . . . 0.0 110.032 -179.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.873 HD12 ' HA ' ' A' ' 88' ' ' HIS . 16.7 mt -56.94 -53.76 61.6 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 121.269 -1.136 . . . . 0.0 110.684 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.577 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 46.1 Cg_endo -73.09 -53.29 0.13 Allowed 'Trans proline' 0 C--N 1.312 -1.353 0 O-C-N 123.289 1.152 . . . . 0.0 110.735 -179.86 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.403 HG23 ' C ' ' A' ' 92' ' ' PRO . 53.5 t -144.93 149.21 17.14 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.367 -0.833 . . . . 0.0 110.027 -179.887 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 74.4 t -53.91 -63.56 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.805 0 O-C-N 121.356 -0.84 . . . . 0.0 110.334 -179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 15.2 t -164.31 -71.99 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.36 -0.837 . . . . 0.0 110.288 179.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -131.84 -62.78 0.84 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.378 -0.826 . . . . 0.0 110.25 -179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.492 1.649 0 CA-C-O 117.999 -1.001 . . . . 0.0 110.243 -179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.152 0.501 . . . . 0.0 110.102 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -140.8 136.48 32.49 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.359 -0.838 . . . . 0.0 110.36 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -69.72 -24.45 63.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.376 -0.827 . . . . 0.0 110.116 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -49.44 -37.05 24.34 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.39 -0.819 . . . . 0.0 110.707 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -62.54 -42.15 99.34 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.355 -0.84 . . . . 0.0 110.111 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.511 ' NH1' HD11 ' A' ' 10' ' ' LEU . 5.8 ttp85 -65.78 -32.88 74.66 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.348 -0.845 . . . . 0.0 110.126 179.891 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 68.5 m-80 -75.4 -25.0 57.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.321 -0.862 . . . . 0.0 110.143 179.896 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 16.7 t -62.23 -50.41 71.86 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.271 -0.893 . . . . 0.0 110.123 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.954 HD23 ' CE1' ' A' ' 68' ' ' TYR . 1.0 OUTLIER -64.81 -36.42 84.28 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.413 -0.805 . . . . 0.0 109.812 179.802 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . 0.511 HD11 ' NH1' ' A' ' 6' ' ' ARG . 50.8 mt -68.73 -31.61 70.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.428 -0.795 . . . . 0.0 109.909 179.663 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 22.0 tt0 -96.84 27.7 3.84 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.415 -0.803 . . . . 0.0 110.01 179.789 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.451 ' CD2' ' HB2' ' A' ' 16' ' ' LEU . 60.5 t60 -112.07 36.57 3.29 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.414 -0.803 . . . . 0.0 110.079 -179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.424 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 35.7 ttp180 -75.07 -64.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.497 -0.752 . . . . 0.0 110.297 -179.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -64.83 -27.64 69.02 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.387 -0.821 . . . . 0.0 110.221 -179.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.86 -50.24 74.24 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.332 -0.855 . . . . 0.0 110.317 -179.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 0.477 ' HA ' ' HB2' ' A' ' 19' ' ' ASP . 0.7 OUTLIER -75.09 -26.25 59.17 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.302 -0.874 . . . . 0.0 110.533 -179.913 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 33.1 tt0 -50.25 -46.06 54.57 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.264 -0.898 . . . . 0.0 110.64 -179.808 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.5 ttpt -85.25 -22.37 28.66 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.421 -0.799 . . . . 0.0 110.531 -179.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 0.477 ' HB2' ' HA ' ' A' ' 16' ' ' LEU . 69.5 m-20 -85.02 -64.99 1.06 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.247 -0.908 . . . . 0.0 110.701 -179.748 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.83 HD13 HG13 ' A' ' 25' ' ' ILE . 43.4 mt -131.4 164.87 33.21 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.783 0 O-C-N 121.154 -0.966 . . . . 0.0 111.045 -179.683 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.581 ' O ' ' C ' ' A' ' 22' ' ' THR . 15.6 mmtp -131.84 142.86 49.83 Favored 'General case' 0 N--CA 1.491 1.592 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.581 ' C ' ' O ' ' A' ' 21' ' ' LYS . 71.9 p -23.15 96.03 0.01 OUTLIER 'General case' 0 N--CA 1.507 2.409 0 CA-C-O 121.641 0.734 . . . . 0.0 110.993 -179.158 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 0.456 ' O ' ' C ' ' A' ' 24' ' ' TYR . 65.2 p -155.84 -175.5 5.47 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.69 -0.631 . . . . 0.0 110.089 -178.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 0.456 ' C ' ' O ' ' A' ' 23' ' ' SER . 12.8 t80 -32.59 -40.68 0.05 Allowed 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.751 -0.593 . . . . 0.0 111.805 -179.561 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.83 HG13 HD13 ' A' ' 20' ' ' ILE . 42.5 mm -55.56 -60.5 1.66 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.792 0 O-C-N 120.94 -1.1 . . . . 0.0 109.541 179.525 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . . . . . . . . . 22.5 mmt -75.53 -34.96 60.82 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.404 -0.81 . . . . 0.0 110.092 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -67.32 -61.33 1.97 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.392 -0.818 . . . . 0.0 110.375 -179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -53.02 -24.98 10.86 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.274 -0.891 . . . . 0.0 110.456 -179.875 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . . . . . . . . . 27.1 mmt -78.16 -34.37 49.74 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.341 -0.849 . . . . 0.0 110.226 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.996 HD11 HD21 ' A' ' 56' ' ' LEU . 73.1 mt -81.96 -43.5 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.648 0 O-C-N 121.276 -0.89 . . . . 0.0 110.15 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 67.3 m -66.8 -19.82 65.82 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.36 -0.837 . . . . 0.0 110.485 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -58.69 -20.29 47.22 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.262 -0.899 . . . . 0.0 110.436 179.871 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 133.96 -6.25 4.75 Favored Glycine 0 N--CA 1.492 2.401 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 -179.914 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 0.422 ' HB2' ' HA ' ' A' ' 30' ' ' ILE . 8.7 m-30 -53.68 -58.41 7.3 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.102 -1.234 . . . . 0.0 110.454 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 0.465 HD21 ' HB2' ' A' ' 63' ' ' LYS . 1.2 mt -132.03 165.06 24.84 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.303 -0.873 . . . . 0.0 110.292 -179.723 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 30.4 p -55.48 144.31 26.31 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.375 -0.828 . . . . 0.0 110.36 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 75.8 mt -74.37 -25.33 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.353 -0.842 . . . . 0.0 110.116 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.0 m -59.26 -46.1 89.43 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.378 -0.826 . . . . 0.0 110.364 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -63.72 -32.78 74.38 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.342 -0.849 . . . . 0.0 110.119 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -63.27 -45.71 90.23 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.816 . . . . 0.0 110.049 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 32.6 tt0 -55.76 -29.94 60.45 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.375 -0.828 . . . . 0.0 110.114 179.849 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 26.0 ttmt -62.86 -54.72 34.4 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.428 -0.795 . . . . 0.0 109.946 179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 94.2 t -44.7 -33.73 1.02 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.979 0 O-C-N 121.572 -0.705 . . . . 0.0 110.557 179.752 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 34.2 ttm180 -49.24 -33.76 13.48 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.552 -0.717 . . . . 0.0 111.291 -179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -145.35 14.09 1.42 Allowed 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.052 -1.03 . . . . 0.0 111.628 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.495 ' HB3' ' HD3' ' A' ' 47' ' ' PRO . 4.5 tm-20 -82.05 -48.61 0.92 Allowed Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 120.878 -1.139 . . . . 0.0 110.959 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.495 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 50.9 Cg_endo -77.97 160.19 30.46 Favored 'Trans proline' 0 C--N 1.314 -1.277 0 O-C-N 123.376 1.198 . . . . 0.0 110.709 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 49.3 m -126.87 -32.24 2.58 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.49 -0.756 . . . . 0.0 110.282 179.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.414 ' CD ' ' H ' ' A' ' 49' ' ' GLN . 0.2 OUTLIER -106.05 -164.07 0.98 Allowed 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.32 -0.863 . . . . 0.0 110.202 179.603 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -57.41 -19.06 21.07 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.327 -0.858 . . . . 0.0 110.628 -179.819 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 -52.49 -21.54 3.87 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.225 -0.922 . . . . 0.0 110.666 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -50.36 -65.27 0.59 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.297 -0.877 . . . . 0.0 110.649 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.601 ' O ' HD12 ' A' ' 57' ' ' ILE . . . -66.08 -47.52 74.0 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.385 -0.822 . . . . 0.0 109.913 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.424 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -52.17 -33.56 41.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.354 -0.841 . . . . 0.0 110.394 179.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 28.3 ttt -81.31 -26.49 35.63 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.337 -0.852 . . . . 0.0 110.109 179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.996 HD21 HD11 ' A' ' 30' ' ' ILE . 5.4 tt -73.05 -50.81 20.84 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.338 -0.851 . . . . 0.0 110.171 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.601 HD12 ' O ' ' A' ' 53' ' ' ALA . 3.1 mp -62.56 -37.57 79.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.399 -0.813 . . . . 0.0 109.913 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -37.35 84.09 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.268 -0.895 . . . . 0.0 109.634 179.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 28.5 mmm -60.94 -30.18 70.07 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.381 -0.825 . . . . 0.0 110.102 179.676 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.578 HD12 ' HA ' ' A' ' 57' ' ' ILE . 93.2 mt -62.32 -46.26 96.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.407 -0.808 . . . . 0.0 109.917 179.72 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.426 HD21 ' HG ' ' A' ' 9' ' ' LEU . 1.9 mm? -73.52 -28.64 62.0 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.438 -0.789 . . . . 0.0 110.547 -179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -61.97 -40.16 94.63 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.319 -0.863 . . . . 0.0 110.501 -179.848 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.465 ' HB2' HD21 ' A' ' 35' ' ' LEU . 11.5 tttm -61.38 -65.47 0.69 Allowed 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.301 -0.874 . . . . 0.0 110.315 -179.722 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -160.42 170.03 21.83 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.373 -0.829 . . . . 0.0 110.293 179.94 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 18.3 m-20 -80.02 -30.12 39.49 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.383 -0.823 . . . . 0.0 110.142 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -62.38 -27.73 69.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.399 -0.813 . . . . 0.0 110.184 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . 0.403 ' OG ' ' CD2' ' A' ' 34' ' ' PHE . 2.9 t -62.85 -39.47 94.5 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.394 -0.816 . . . . 0.0 110.085 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.954 ' CE1' HD23 ' A' ' 9' ' ' LEU . 5.5 t80 -62.08 -39.61 93.01 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.418 -0.801 . . . . 0.0 110.015 179.855 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 63.5 t -64.9 -41.77 93.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.316 -0.865 . . . . 0.0 109.964 179.951 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 38.4 t -63.06 -37.35 86.85 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.388 -0.82 . . . . 0.0 110.057 179.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.538 ' CE1' HD11 ' A' ' 75' ' ' LEU . 6.5 t80 -54.18 -35.96 62.9 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.371 -0.83 . . . . 0.0 109.767 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.691 ' CE1' HD11 ' A' ' 76' ' ' LEU . 28.4 t80 -63.59 -45.82 88.65 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.419 -0.8 . . . . 0.0 110.078 179.816 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -69.65 -28.45 65.9 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.256 -0.903 . . . . 0.0 110.296 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -60.88 -55.64 30.62 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.3 -0.875 . . . . 0.0 110.419 -179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.538 HD11 ' CE1' ' A' ' 71' ' ' PHE . 11.9 mt -60.72 -35.96 77.63 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.374 -0.829 . . . . 0.0 110.39 -179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.691 HD11 ' CE1' ' A' ' 72' ' ' TYR . 30.3 mt -71.71 -14.98 62.19 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.446 -0.784 . . . . 0.0 110.623 -179.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . . . . . . . . . 39.4 t-80 -59.71 -33.06 71.12 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.194 -0.941 . . . . 0.0 110.656 -179.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 27.8 mt-10 -105.52 -75.37 0.63 Allowed 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -0.918 . . . . 0.0 110.392 -179.665 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -174.95 35.22 0.1 Allowed Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.575 -1.41 . . . . 0.0 109.575 -179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 74.1 m-85 -95.68 16.32 17.65 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.36 -1.083 . . . . 0.0 110.311 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -45.0 -29.45 0.84 Allowed 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.412 -0.805 . . . . 0.0 110.863 -179.719 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -62.55 -50.17 72.4 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.269 -0.894 . . . . 0.0 109.757 179.549 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.656 ' C ' HD13 ' A' ' 83' ' ' LEU . 3.4 tm? -74.56 -41.79 59.92 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.38 -0.825 . . . . 0.0 109.587 179.524 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.84 -32.47 73.69 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.421 -0.799 . . . . 0.0 109.999 179.83 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . . . . . . . . . . . -65.98 -34.61 78.49 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.436 -0.79 . . . . 0.0 110.128 179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 21.0 tp -58.91 -46.73 87.2 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.301 -0.874 . . . . 0.0 110.455 -179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.413 HD12 ' O ' ' A' ' 83' ' ' LEU . 1.8 mp -74.86 -47.41 30.4 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.336 -0.853 . . . . 0.0 110.332 -179.955 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.474 ' HB2' ' CE1' ' A' ' 72' ' ' TYR . 67.8 t60 -59.85 -44.12 94.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.38 -0.825 . . . . 0.0 110.516 -179.696 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -58.23 -20.64 43.39 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.329 -0.857 . . . . 0.0 110.534 -179.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -107.08 14.15 40.52 Favored Glycine 0 N--CA 1.491 2.303 0 N-CA-C 110.187 -1.165 . . . . 0.0 110.187 -179.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.63 ' HB ' ' HD3' ' A' ' 92' ' ' PRO . 7.8 mm -74.08 -57.12 2.42 Favored Pre-proline 0 N--CA 1.491 1.622 0 O-C-N 121.06 -1.259 . . . . 0.0 109.984 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.63 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 42.6 Cg_endo -72.9 -81.18 0.01 OUTLIER 'Trans proline' 0 C--N 1.314 -1.286 0 O-C-N 123.347 1.182 . . . . 0.0 110.476 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.403 HG12 ' N ' ' A' ' 94' ' ' VAL . 65.5 t -134.3 162.72 38.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.704 0 O-C-N 121.183 -0.948 . . . . 0.0 109.94 179.866 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 0.403 ' N ' HG12 ' A' ' 93' ' ' VAL . 85.1 t -94.27 -77.15 0.34 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.306 -0.871 . . . . 0.0 110.275 -179.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 12.7 t -165.08 -41.62 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.215 -0.928 . . . . 0.0 110.261 179.954 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 13.4 p -60.44 -72.88 0.1 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.362 -0.836 . . . . 0.0 110.154 -179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 35.2 m . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 118.034 -0.984 . . . . 0.0 110.241 179.931 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . 0.487 0.0 OUTLIER . . . . . 3 N--CA 1.082 -18.859 0 N-CA-C 115.254 1.576 . . . . 3.48 115.254 . . . . . . . . . 3 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ASP . . . . . 1.213 ' OD2' ' CB ' ' A' ' 2' ' ' ASP . 3.5 p30 -114.37 129.42 56.65 Favored 'General case' 1 C--N 1.131 -8.921 0 O-C-N 116.508 -3.87 . . . . 1.9199999999999999 113.191 -179.972 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -71.19 -27.68 63.68 Favored 'General case' 0 C--N 1.282 -2.33 0 O-C-N 121.434 -0.791 . . . . 0.77000000000000002 110.335 -179.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 1.248 ' CE ' ' CG ' ' A' ' 4' ' ' LYS . 10.3 tttt -57.31 -37.56 72.67 Favored 'General case' 0 C--N 1.293 -1.877 0 O-C-N 121.424 -0.797 . . . . 2.0600000000000001 110.491 -179.811 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . 0.433 ' HB2' ' OD1' ' A' ' 2' ' ' ASP . . . -62.48 -39.39 93.29 Favored 'General case' 0 C--N 1.298 -1.634 0 O-C-N 121.155 -0.966 . . . . 0.37 110.154 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 68.5 ttt180 -66.43 -33.45 75.74 Favored 'General case' 0 C--N 1.298 -1.664 0 O-C-N 121.29 -0.881 . . . . 2.5299999999999998 110.11 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ASN . . . . . 1.038 ' ND2' ' CB ' ' A' ' 7' ' ' ASN . 3.3 m-20 -72.82 -28.64 62.67 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.395 -0.816 . . . . 1.21 110.182 179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 29.6 t -61.13 -55.13 36.01 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.418 -0.801 . . . . 0.64000000000000001 110.249 179.94 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.772 HD13 ' O ' ' A' ' 9' ' ' LEU . 1.2 tm? -59.24 -36.03 74.74 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 121.029 -1.044 . . . . 0.35999999999999999 110.034 179.86 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 66.5 mt -71.01 -28.72 64.62 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.42 -0.8 . . . . 0.68000000000000005 110.242 179.738 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 1.178 ' NE2' ' CG ' ' A' ' 11' ' ' GLN . 55.1 tt0 -100.15 20.06 15.28 Favored 'General case' 0 C--O 1.171 -3.037 0 CA-C-O 121.526 0.679 . . . . 2.1400000000000001 110.53 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' HIS . . . . . 0.938 ' CD2' ' HB3' ' A' ' 15' ' ' ALA . 3.6 t-160 -112.83 30.88 6.8 Favored 'General case' 0 C--N 1.262 -3.2 0 O-C-N 120.166 -1.584 . . . . 2.27 111.541 179.931 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . 0.706 ' HD2' ' HB2' ' A' ' 54' ' ' ALA . 49.2 ttp180 -72.97 -43.92 61.69 Favored 'General case' 0 C--N 1.274 -2.679 0 O-C-N 121.292 -0.88 . . . . 2.1600000000000001 110.929 -179.93 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 1.036 ' OE1' ' CG ' ' A' ' 14' ' ' GLU . 69.6 tt0 -62.25 -33.91 75.51 Favored 'General case' 0 C--N 1.301 -1.512 0 O-C-N 121.107 -0.995 . . . . 1.3100000000000001 110.455 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ALA . . . . . 0.938 ' HB3' ' CD2' ' A' ' 12' ' ' HIS . . . -78.43 -42.9 28.73 Favored 'General case' 0 C--O 1.195 -1.798 0 O-C-N 121.231 -0.918 . . . . 0.63 110.59 179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' LEU . . . . . 1.306 ' CD2' ' CB ' ' A' ' 16' ' ' LEU . 0.8 OUTLIER -67.19 -38.93 86.22 Favored 'General case' 0 C--N 1.29 -1.995 0 O-C-N 121.1 -1.0 . . . . 1.49 110.152 -179.985 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 1.058 ' OE1' ' CG ' ' A' ' 17' ' ' GLU . 60.2 tt0 -60.22 -41.99 94.21 Favored 'General case' 0 C--N 1.297 -1.689 0 O-C-N 121.466 -0.771 . . . . 1.73 110.638 179.985 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 80.3 tttt -78.11 -32.62 50.6 Favored 'General case' 0 C--O 1.184 -2.392 0 O-C-N 121.173 -0.954 . . . . 1.8400000000000001 110.575 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . 1.012 ' OD1' ' CB ' ' A' ' 19' ' ' ASP . 65.9 m-20 -82.75 -63.7 1.32 Allowed 'General case' 0 C--N 1.272 -2.768 0 O-C-N 120.337 -1.477 . . . . 1.3799999999999999 111.564 -179.851 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.573 HD12 HG21 ' A' ' 25' ' ' ILE . 0.5 OUTLIER -119.39 136.45 56.52 Favored 'Isoleucine or valine' 1 C--O 1.102 -6.689 0 O-C-N 120.73 -1.231 . . . . 1.04 112.225 -179.883 . . . . . . . . 4 4 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.68 ' O ' ' HB2' ' A' ' 23' ' ' SER . 88.5 mttt -112.85 141.99 46.03 Favored 'General case' 1 C--N 1.224 -4.851 0 O-C-N 116.772 -3.705 . . . . 1.95 109.125 179.37 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.625 HG21 ' HG2' ' A' ' 52' ' ' ARG . 75.7 p -24.2 97.41 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.957 0 CA-C-O 121.505 0.669 . . . . 0.48999999999999999 111.212 -179.376 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' SER . . . . . 1.073 ' OG ' ' CB ' ' A' ' 23' ' ' SER . 0.4 OUTLIER -156.33 -176.21 5.84 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.409 -0.807 . . . . 1.1100000000000001 110.233 -178.648 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TYR . . . . . 1.392 ' CZ ' ' CD2' ' A' ' 24' ' ' TYR . 12.8 t80 -33.23 -39.82 0.05 Allowed 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.805 -0.559 . . . . 1.26 111.943 -179.688 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.573 HG21 HD12 ' A' ' 20' ' ' ILE . 44.0 mm -55.74 -62.7 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 O-C-N 120.962 -1.086 . . . . 0.32000000000000001 110.079 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' MET . . . . . 1.279 ' SD ' ' CE ' ' A' ' 26' ' ' MET . 1.6 mmt -75.54 -38.03 59.59 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.313 -0.867 . . . . 1.21 110.473 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ASP . . . . . 1.044 ' OD1' ' CB ' ' A' ' 27' ' ' ASP . 5.0 t70 -61.03 -53.87 51.87 Favored 'General case' 0 C--N 1.294 -1.842 0 O-C-N 120.89 -1.131 . . . . 1.1799999999999999 110.705 -179.767 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' HIS . . . . . 1.408 ' CG ' ' CE1' ' A' ' 28' ' ' HIS . 18.4 t-160 -57.05 -34.22 68.01 Favored 'General case' 0 C--N 1.297 -1.704 0 O-C-N 120.887 -1.133 . . . . 1.22 110.361 -179.862 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' MET . . . . . 1.344 ' CE ' ' CB ' ' A' ' 29' ' ' MET . 2.8 mtt -68.51 -41.82 79.44 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 120.943 -1.098 . . . . 2.7000000000000002 110.411 179.962 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ILE . . . . . 0.597 HG23 ' HB2' ' A' ' 35' ' ' LEU . 86.1 mt -64.15 -42.9 97.02 Favored 'Isoleucine or valine' 0 C--O 1.188 -2.169 0 O-C-N 120.91 -1.119 . . . . 0.91000000000000003 110.382 -179.971 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 55.1 m -77.52 -18.81 56.66 Favored 'General case' 0 C--N 1.283 -2.32 0 O-C-N 120.496 -1.377 . . . . 0.58999999999999997 110.501 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASP . . . . . 1.097 ' OD2' ' CB ' ' A' ' 32' ' ' ASP . 4.9 t70 -58.9 -22.85 60.28 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.087 -1.008 . . . . 1.3200000000000001 110.453 -179.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 138.82 -12.49 3.4 Favored Glycine 0 N--CA 1.487 2.057 0 N-CA-C 110.109 -1.196 . . . . 0.39000000000000001 110.109 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PHE . . . . . 1.387 ' CZ ' ' CD1' ' A' ' 34' ' ' PHE . 12.7 m-30 -59.42 -61.51 2.57 Favored 'General case' 0 C--N 1.298 -1.672 0 O-C-N 120.851 -1.382 . . . . 1.29 110.37 -179.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' LEU . . . . . 1.291 ' CD1' ' CB ' ' A' ' 35' ' ' LEU . 5.6 mp -119.39 162.93 17.98 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.214 -0.929 . . . . 1.3799999999999999 110.558 -179.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 24.9 p -61.52 157.7 16.6 Favored 'General case' 0 C--O 1.199 -1.603 0 O-C-N 121.201 -0.937 . . . . 0.59999999999999998 110.344 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 11.3 mt -75.97 -22.36 15.86 Favored 'Isoleucine or valine' 0 C--N 1.285 -2.2 0 O-C-N 120.807 -1.183 . . . . 1.21 110.459 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 42.5 m -59.17 -30.05 67.9 Favored 'General case' 0 C--N 1.297 -1.709 0 O-C-N 121.308 -0.87 . . . . 0.68999999999999995 110.456 -179.967 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -67.07 -31.9 72.71 Favored 'General case' 0 C--N 1.283 -2.308 0 O-C-N 121.176 -0.952 . . . . 1.78 110.712 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 1.163 ' CD ' ' CB ' ' A' ' 40' ' ' GLU . 7.4 tt0 -65.89 -38.8 89.71 Favored 'General case' 0 C--N 1.293 -1.856 0 CA-C-O 121.956 0.884 . . . . 2.3199999999999998 110.406 -179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' GLU . . . . . 1.127 ' OE2' ' CG ' ' A' ' 41' ' ' GLU . 32.5 tt0 -64.94 -30.93 71.95 Favored 'General case' 0 C--N 1.277 -2.576 0 O-C-N 120.946 -1.096 . . . . 1.75 110.692 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.495 ' O ' ' HB2' ' A' ' 46' ' ' GLU . 10.5 ttmt -75.99 -56.95 4.18 Favored 'General case' 0 C--N 1.283 -2.311 0 O-C-N 120.903 -1.123 . . . . 1.52 110.407 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 83.0 t -50.12 -33.78 9.99 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.486 0 O-C-N 121.495 -0.753 . . . . 0.51000000000000001 110.638 179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 23.5 ttt180 -47.38 -40.4 17.53 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.564 -0.71 . . . . 2.8199999999999998 111.613 -179.522 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 1.202 ' OD1' ' CB ' ' A' ' 45' ' ' ASN . 2.4 t30 -143.72 16.59 1.8 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.026 -1.046 . . . . 1.3500000000000001 111.225 -179.651 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . 1.273 ' CD ' ' CB ' ' A' ' 46' ' ' GLU . 1.4 tt0 -80.24 -50.88 1.11 Allowed Pre-proline 0 C--N 1.299 -1.606 0 O-C-N 120.867 -1.145 . . . . 2.52 110.893 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.746 ' HD3' ' HB3' ' A' ' 46' ' ' GLU . 48.4 Cg_endo -75.81 168.81 23.52 Favored 'Trans proline' 0 C--N 1.309 -1.544 0 O-C-N 123.127 1.067 . . . . 0.57999999999999996 110.465 -179.82 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 19.5 m -135.94 -42.21 0.66 Allowed 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.47 -0.769 . . . . 0.84999999999999998 110.517 179.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 1.514 ' NE2' ' CG ' ' A' ' 49' ' ' GLN . 12.6 mm-40 -95.37 -159.05 0.69 Allowed 'General case' 0 C--N 1.289 -2.063 0 O-C-N 120.915 -1.116 . . . . 2.0099999999999998 110.063 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 mp0 -65.74 -12.69 55.92 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.26 -0.9 . . . . 2.6099999999999999 110.952 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' GLN . . . . . 1.041 ' OE1' ' CG ' ' A' ' 51' ' ' GLN . 56.5 tt0 -56.36 -20.2 18.11 Favored 'General case' 0 N--CA 1.488 1.44 0 O-C-N 121.288 -0.882 . . . . 1.45 110.75 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 1.445 ' CD ' ' CZ ' ' A' ' 52' ' ' ARG . 45.5 ttt180 -51.44 -48.9 62.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.174 -0.954 . . . . 2.1099999999999999 110.752 -179.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ALA . . . . . 0.637 ' O ' HD13 ' A' ' 57' ' ' ILE . . . -77.3 -34.8 55.41 Favored 'General case' 1 C--O 1.147 -4.314 0 O-C-N 120.679 -1.263 . . . . 0.78000000000000003 110.318 -179.959 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.706 ' HB2' ' HD2' ' A' ' 13' ' ' ARG . . . -63.15 -36.75 84.64 Favored 'General case' 1 C--N 1.241 -4.11 0 O-C-N 118.042 -2.911 . . . . 0.56999999999999995 110.666 -179.811 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' MET . . . . . 1.393 ' CE ' ' CG ' ' A' ' 55' ' ' MET . 11.8 ttt -78.26 -34.54 48.97 Favored 'General case' 0 C--N 1.293 -1.858 0 O-C-N 121.194 -0.941 . . . . 1.76 110.246 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 13.3 tp -69.16 -41.58 77.06 Favored 'General case' 0 C--N 1.287 -2.152 0 O-C-N 120.616 -1.303 . . . . 0.82999999999999996 110.441 -179.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.637 HD13 ' O ' ' A' ' 53' ' ' ALA . 0.5 OUTLIER -65.62 -37.37 79.82 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.591 0 O-C-N 121.1 -1.0 . . . . 0.59999999999999998 110.174 179.915 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -66.8 -39.91 87.93 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.044 -1.035 . . . . 1.3999999999999999 110.017 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' MET . . . . . 1.304 ' SD ' ' CE ' ' A' ' 59' ' ' MET . 5.6 mmt -58.62 -31.18 67.85 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.29 -0.882 . . . . 1.4399999999999999 110.229 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ILE . . . . . 0.628 HD12 ' HA ' ' A' ' 57' ' ' ILE . 98.6 mt -63.59 -53.96 38.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.303 -0.873 . . . . 0.39000000000000001 109.938 179.83 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.459 HD21 ' HG ' ' A' ' 9' ' ' LEU . 2.0 mm? -75.24 -32.46 61.12 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.405 -0.809 . . . . 0.42999999999999999 110.672 -179.775 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 1.47 ' CD ' ' NZ ' ' A' ' 62' ' ' LYS . 16.9 mmtt -61.19 -27.9 68.75 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.15 -0.969 . . . . 1.76 110.567 -179.833 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 1.532 ' CG ' ' CE ' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -73.43 -65.0 0.87 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.233 -0.917 . . . . 2.4700000000000002 110.363 -179.917 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 1.18 ' OD2' ' CB ' ' A' ' 64' ' ' ASP . 13.4 t0 -159.73 165.34 32.72 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.345 -0.847 . . . . 1.75 110.211 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . 0.997 ' ND2' ' CB ' ' A' ' 65' ' ' ASN . 2.7 m-20 -80.07 -26.4 39.66 Favored 'General case' 0 C--N 1.301 -1.539 0 O-C-N 121.287 -0.883 . . . . 0.98999999999999999 110.32 179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.997 ' OD2' ' CB ' ' A' ' 66' ' ' ASP . 12.4 m-20 -61.43 -35.36 77.34 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.299 -0.876 . . . . 1.24 110.347 179.952 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 40.4 t -62.59 -34.57 77.27 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.274 -0.891 . . . . 0.46999999999999997 110.162 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 1.395 ' CZ ' ' CD2' ' A' ' 68' ' ' TYR . 19.3 t80 -64.33 -38.53 91.37 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.211 -0.931 . . . . 1.26 110.068 179.882 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 59.7 t -68.0 -39.32 81.36 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.281 -0.887 . . . . 0.32000000000000001 110.052 179.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 34.6 t -66.78 -36.53 82.62 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.23 -0.919 . . . . 0.27000000000000002 110.054 179.883 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 1.426 ' CZ ' ' CD1' ' A' ' 71' ' ' PHE . 1.2 t80 -55.43 -37.43 67.67 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.288 -0.882 . . . . 1.24 109.886 179.716 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 1.367 ' CG ' ' CE2' ' A' ' 72' ' ' TYR . 44.8 t80 -64.41 -43.85 93.09 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.308 -0.87 . . . . 1.25 110.104 179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASN . . . . . 1.011 ' ND2' ' CB ' ' A' ' 73' ' ' ASN . 8.9 t30 -75.44 -26.73 58.55 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.271 -0.893 . . . . 1.01 110.463 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -65.21 -41.03 94.87 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.213 -0.93 . . . . 0.32000000000000001 110.338 -179.861 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.449 HD11 ' CZ ' ' A' ' 71' ' ' PHE . 16.8 mt -75.26 -38.44 60.47 Favored 'General case' 0 C--N 1.298 -1.645 0 O-C-N 120.949 -1.095 . . . . 0.40000000000000002 110.274 -179.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.735 HD11 ' CE1' ' A' ' 72' ' ' TYR . 29.9 mt -67.25 -15.13 63.52 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.405 -0.809 . . . . 0.41999999999999998 110.554 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' HIS . . . . . 1.387 ' CG ' ' CE1' ' A' ' 77' ' ' HIS . 3.5 t-80 -62.32 -24.7 67.47 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.213 -0.929 . . . . 1.24 110.751 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . 1.447 ' OE1' ' CG ' ' A' ' 78' ' ' GLU . 28.0 mt-10 -109.74 -75.21 0.63 Allowed 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.172 -0.955 . . . . 1.5900000000000001 110.414 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -173.89 47.77 0.15 Allowed Glycine 0 C--O 1.187 -2.791 0 N-CA-C 109.438 -1.465 . . . . 0.55000000000000004 109.438 -179.946 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' TYR . . . . . 1.409 ' CG ' ' CE2' ' A' ' 80' ' ' TYR . 34.6 m-85 -106.16 16.22 25.23 Favored 'General case' 0 C--N 1.276 -2.599 0 O-C-N 120.029 -1.865 . . . . 1.3799999999999999 110.534 -179.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . 1.423 ' CD ' ' NZ ' ' A' ' 81' ' ' LYS . 46.6 tttt -44.88 -31.59 1.3 Allowed 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.424 -0.797 . . . . 1.6699999999999999 110.953 -179.759 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . 1.005 ' OD1' ' CB ' ' A' ' 82' ' ' ASP . 2.7 m-20 -68.34 -51.98 38.38 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.246 -0.909 . . . . 1.26 109.9 179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.413 ' O ' HD12 ' A' ' 87' ' ' LEU . 0.0 OUTLIER -72.12 -44.12 63.65 Favored 'General case' 0 C--N 1.295 -1.792 0 O-C-N 121.048 -1.033 . . . . 1.52 110.174 179.682 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.02 -35.06 74.25 Favored 'General case' 0 C--N 1.3 -1.573 0 O-C-N 121.405 -0.81 . . . . 0.46000000000000002 110.228 179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.435 ' HB2' ' O ' ' A' ' 81' ' ' LYS . . . -62.43 -36.0 81.02 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.306 -0.871 . . . . 0.5 110.169 179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' LEU . . . . . 1.284 ' CD2' ' CB ' ' A' ' 86' ' ' LEU . 9.1 tp -60.31 -43.54 96.25 Favored 'General case' 0 C--N 1.301 -1.533 0 O-C-N 121.35 -0.844 . . . . 1.5900000000000001 110.368 179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.481 ' O ' HG13 ' A' ' 91' ' ' ILE . 0.9 OUTLIER -75.29 -35.44 61.3 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.208 -0.933 . . . . 0.56000000000000005 110.25 -179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' HIS . . . . . 1.431 ' CG ' ' CE1' ' A' ' 88' ' ' HIS . 22.7 t-80 -68.97 -39.25 79.57 Favored 'General case' 0 C--O 1.187 -2.226 0 O-C-N 120.93 -1.106 . . . . 1.3200000000000001 110.559 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ASP . . . . . 0.981 ' OD1' ' CB ' ' A' ' 89' ' ' ASP . 53.4 m-20 -69.67 -18.87 63.6 Favored 'General case' 0 C--N 1.278 -2.542 0 O-C-N 120.165 -1.585 . . . . 1.3200000000000001 110.908 -179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -93.63 -14.78 52.21 Favored Glycine 0 C--O 1.189 -2.681 0 C-N-CA 119.709 -1.234 . . . . 0.63 110.363 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.624 HD12 ' HA ' ' A' ' 88' ' ' HIS . 33.9 mt -64.75 -54.33 36.72 Favored Pre-proline 0 C--N 1.286 -2.188 0 O-C-N 120.488 -1.596 . . . . 0.70999999999999996 110.452 -179.826 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' PRO . . . . . 0.61 ' HD3' ' HB ' ' A' ' 91' ' ' ILE . 43.7 Cg_endo -71.91 -77.32 0.01 OUTLIER 'Trans proline' 0 C--O 1.178 -2.525 0 O-C-N 123.158 1.083 . . . . 0.81000000000000005 110.762 179.949 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' VAL . . . . . 0.656 HG12 ' N ' ' A' ' 94' ' ' VAL 0.268 58.9 t -131.26 156.36 42.64 Favored 'Isoleucine or valine' 2 C--O 1.075 -8.098 0 CA-C-O 115.84 -2.029 . . . . 1.6699999999999999 114.69 179.903 . . . . . . . . 4 3 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' VAL . . . . . 1.023 ' C ' ' OXT' ' A' ' 97' ' ' SER 0.311 59.8 t -96.38 -44.59 12.87 Favored 'Isoleucine or valine' 3 C--O 0.971 -13.573 0 CA-C-N 121.248 1.84 . . . . 2.4500000000000002 114.471 -179.953 . . . . . . . . 4 3 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.756 ' N ' ' OXT' ' A' ' 97' ' ' SER 0.79 48.4 t -100.96 -46.52 5.07 Favored 'General case' 4 C--O 0.734 -26.04 2 CA-C-O 147.325 12.964 . . . . 3.8900000000000001 139.397 -179.958 . . . . . . . . 5 3 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . 1.005 21.2 t -95.88 -11.97 25.91 Favored 'General case' 4 C--N 0.49 -36.797 3 O-C-N 96.876 -16.14 . . . . 4.2300000000000004 87.062 -179.896 . . . . . . . . 4 2 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' SER . . . . . 1.023 ' OXT' ' C ' ' A' ' 94' ' ' VAL 1.351 4.7 m . . . . . 4 C--O 0.283 -49.812 3 CA-C-O 154.849 16.547 . . . . 6.0099999999999998 123.543 179.93 . . . . . . . . 4 2 . 1 stop_ save_