data_6wqj_residue ############################ # Computer software used # ############################ 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 6wqj _Structure_validation_residue.Date_analyzed 2020-10-23 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp . . . . . 0 N--CA 1.439 -1.005 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.91 -29.62 66.84 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.147 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.0 m -61.58 -40.02 93.25 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.819 178.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -50.39 68.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.165 177.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 53.0 mt -58.18 -52.07 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-O 121.323 0.582 . . . . 0.0 109.977 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.2 t -52.17 -44.7 64.78 Favored 'General case' 0 C--O 1.248 0.99 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.89 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.2 -38.42 31.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.881 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.53 -30.28 71.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -57.56 -51.73 68.28 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.8 m -65.91 -30.18 70.72 Favored 'General case' 0 C--O 1.192 -1.949 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.893 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.47 -29.24 69.32 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.106 0.479 . . . . 0.0 110.197 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -87.08 -47.07 16.14 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.291 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.5 tpt -71.61 -42.01 68.22 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -136.35 83.84 30.8 Favored Pre-proline 0 C--N 1.312 -1.04 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.71 119.12 4.7 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.422 2.082 . . . . 0.0 112.583 -176.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 46.61 75.87 0.11 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.654 1.182 . . . . 0.0 113.292 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.82 -143.42 9.14 Favored Glycine 0 C--N 1.301 -1.375 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -128.89 -80.45 0.27 Allowed Glycine 0 C--N 1.297 -1.619 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -64.99 -28.39 69.48 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -56.11 -43.06 77.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.076 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -70.47 -44.91 66.77 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.555 -178.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -55.96 -53.65 54.37 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 124.016 0.823 . . . . 0.0 110.342 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 mtm180 -62.4 -51.55 67.11 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.728 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 m -57.28 -48.34 79.14 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.075 0.234 . . . . 0.0 111.009 -178.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.28 -51.2 67.07 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.528 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 1.2 tm-20 -61.89 -38.26 87.69 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 124.399 1.079 . . . . 0.0 109.657 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 39.1 t -65.23 -50.72 64.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.126 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.51 -28.93 69.99 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -65.48 -36.44 83.89 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.241 0.616 . . . . 0.0 110.068 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.6 mtt180 -81.16 -55.2 4.91 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.195 0.998 . . . . 0.0 109.769 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.5 tp . . . . . 0 C--N 1.307 -1.268 0 CA-C-N 113.745 -1.57 . . . . 0.0 113.707 -168.672 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 6' ' ' ILE . 65.8 mttm . . . . . 0 N--CA 1.425 -1.713 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -71.39 -39.54 71.1 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.4 m -68.5 -34.18 75.44 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 113.278 -1.783 . . . . 0.0 109.077 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.51 -44.22 96.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.575 176.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 2' ' ' LYS . 86.5 mt -61.65 -54.94 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -48.02 -48.02 33.12 Favored 'General case' 0 C--O 1.256 1.422 0 C-N-CA 124.398 1.079 . . . . 0.0 112.093 176.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HD3' ' C ' ' A' ' 8' ' ' ARG . 1.1 tmt_? -66.96 -44.87 79.41 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 119.561 -0.257 . . . . 0.0 110.425 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -62.11 -30.8 71.27 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.353 0.597 . . . . 0.0 110.61 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -63.15 -55.67 23.28 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.355 172.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 m -64.4 -29.98 71.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -56.39 -46.84 79.93 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.039 0.936 . . . . 0.0 110.172 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 63.6 t -85.61 -48.14 16.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.123 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' MET . . . . . 0.443 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 15.3 tpt -64.92 -28.09 69.29 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -173.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -112.88 98.4 45.06 Favored Pre-proline 0 C--N 1.312 -1.065 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . 0.443 ' HD3' ' O ' ' A' ' 14' ' ' MET . 60.6 Cg_endo -104.32 137.92 0.1 Allowed 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.417 2.744 . . . . 0.0 113.978 175.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 70.89 -17.53 0.3 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 171.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.439 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -90.4 105.42 3.25 Favored Glycine 0 C--N 1.304 -1.205 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.245 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.94 -34.1 87.71 Favored Glycine 0 N--CA 1.464 0.523 0 C-N-CA 121.576 -0.345 . . . . 0.0 113.121 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -63.52 -44.4 94.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.04 -40.24 95.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.647 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 14.8 mm100 -56.73 -56.55 19.99 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.929 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -66.57 -39.35 88.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.056 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -58.1 -53.11 61.95 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 m -55.17 -41.98 72.57 Favored 'General case' 0 CA--C 1.509 -0.626 0 O-C-N 124.144 0.903 . . . . 0.0 112.868 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.21 -49.01 73.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.977 0.418 . . . . 0.0 109.941 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -64.58 -42.35 95.67 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.982 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -76.4 -27.25 56.25 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.579 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.3 t -73.12 -33.63 65.66 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -63.22 -46.08 88.63 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 171.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -58.38 -38.31 77.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.663 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -67.42 -40.74 85.53 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 123.713 0.805 . . . . 0.0 111.178 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 64.4 tp . . . . . 0 C--N 1.316 -0.888 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.889 -178.746 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 63.9 mttp . . . . . 0 N--CA 1.449 -0.492 0 CA-C-O 121.174 0.511 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 45.6 mt-10 -71.19 -25.73 62.65 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.01 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -76.83 -41.6 43.61 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.63 -53.28 59.95 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.397 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.3 pt -68.79 -35.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.45 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 17.5 t -57.72 -42.19 83.28 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 122.818 0.447 . . . . 0.0 110.194 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -80.56 -50.73 9.62 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.005 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.99 -39.51 71.97 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.409 0.443 . . . . 0.0 112.037 -174.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -58.04 -51.59 69.05 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 123.35 0.406 . . . . 0.0 110.066 -177.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.4 m -73.14 -34.81 66.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -61.2 -39.52 90.52 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.303 0.573 . . . . 0.0 110.575 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -82.41 -30.47 9.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.394 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 27.6 ttt -64.72 -55.2 21.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.346 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.456 ' HZ1' ' CD ' ' A' ' 21' ' ' GLU . 13.9 mmmm -145.26 95.06 5.14 Favored Pre-proline 0 C--N 1.317 -0.845 0 C-N-CA 123.277 0.631 . . . . 0.0 109.558 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -74.39 123.09 7.94 Favored 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.526 2.151 . . . . 0.0 110.448 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 68.59 177.73 0.25 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.878 0.871 . . . . 0.0 111.872 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.25 -145.91 16.1 Favored Glycine 0 N--CA 1.432 -1.625 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -143.88 -73.89 0.03 OUTLIER Glycine 0 N--CA 1.437 -1.291 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.702 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.73 -43.41 93.49 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.07 0.462 . . . . 0.0 111.776 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.456 ' CD ' ' HZ1' ' A' ' 15' ' ' LYS . 40.2 mt-10 -65.46 -27.7 68.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.209 0.528 . . . . 0.0 110.206 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -71.03 -39.05 72.56 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.358 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -64.89 -45.23 86.81 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.565 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 19.9 tpp180 -54.99 -57.32 12.18 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 123.996 0.81 . . . . 0.0 110.851 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 18.6 m -62.78 -31.85 72.9 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.09 -47.6 67.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.21 176.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.47 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 47.5 mm-40 -61.98 -49.52 75.75 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.098 177.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.6 t -66.7 -55.26 15.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.245 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.75 -32.65 74.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -173.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.31 -17.53 39.26 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.009 -1.077 . . . . 0.0 112.525 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -81.26 -40.58 23.52 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 62.7 tp . . . . . 0 C--N 1.314 -0.95 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.905 177.599 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt . . . . . 0 N--CA 1.445 -0.72 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -65.14 -27.86 69.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.171 -178.137 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.8 m -72.24 -48.08 45.49 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.399 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.93 -48.9 79.71 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.45 -40.05 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.089 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 26.2 t -55.03 -47.82 74.22 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.6 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -80.02 -39.25 30.31 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.501 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.421 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.7 tt0 -58.74 -37.62 76.6 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.5 0.72 . . . . 0.0 111.799 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -60.02 -52.23 66.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.88 -28.66 65.83 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.885 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.421 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 7.6 tt0 -57.89 -47.3 83.18 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 124.023 0.929 . . . . 0.0 110.079 177.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.0 m -87.05 -25.1 6.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.877 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 50.1 tpp -75.96 -49.24 18.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.479 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -134.85 80.57 48.83 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -178.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -71.87 118.66 5.75 Favored 'Trans proline' 0 C--O 1.248 0.987 0 C-N-CA 121.749 1.633 . . . . 0.0 111.249 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 59.68 20.43 9.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.943 0.897 . . . . 0.0 112.702 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -87.26 75.51 2.15 Favored Glycine 0 C--O 1.217 -0.925 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -30.11 -54.83 0.22 Allowed Glycine 0 N--CA 1.479 1.535 0 C-N-CA 126.212 1.863 . . . . 0.0 117.093 -173.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.78 -55.81 26.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 117.87 0.835 . . . . 0.0 111.399 -177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.68 -21.53 60.23 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.819 -177.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 30.1 tt0 -72.78 -41.73 64.69 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.616 176.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -70.93 -30.57 66.93 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 175.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 20.6 tpp180 -57.93 -50.24 74.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.6 m -58.67 -40.47 83.6 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.402 175.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 15.0 mm100 -59.37 -47.59 84.84 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.043 0.214 . . . . 0.0 110.472 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -60.34 -49.59 76.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.98 0.8 . . . . 0.0 110.276 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 44.2 mt-10 -64.33 -34.07 77.3 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.1 t -70.02 -41.48 74.24 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 46.6 mt-10 -63.21 -40.97 98.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -19.36 61.59 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.118 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -86.05 -50.42 7.05 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.088 0.471 . . . . 0.0 110.289 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.9 mt . . . . . 0 C--N 1.318 -0.763 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.389 -175.679 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp . . . . . 0 N--CA 1.444 -0.729 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.55 -31.37 72.52 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.424 0.63 . . . . 0.0 110.237 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.3 m -79.08 -33.43 44.53 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.949 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -63.16 -51.6 65.78 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.33 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 69.2 mt -56.3 -46.31 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.2 t -54.2 -51.0 65.79 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 113.855 -1.521 . . . . 0.0 112.041 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -65.55 -43.0 91.24 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.528 -0.108 . . . . 0.0 110.773 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -61.25 -39.27 89.74 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -61.96 -54.39 42.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 123.575 0.547 . . . . 0.0 109.525 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 m -64.24 -29.91 70.98 Favored 'General case' 0 C--O 1.203 -1.395 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -66.06 -40.87 91.26 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 120.896 0.379 . . . . 0.0 110.765 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.8 p -89.06 -38.6 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 94.5 mmm -80.59 -25.33 38.55 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.17 96.13 49.82 Favored Pre-proline 0 C--N 1.309 -1.184 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -94.66 120.0 0.29 Allowed 'Trans proline' 0 N--CA 1.445 -1.377 0 C-N-CA 122.067 1.844 . . . . 0.0 111.989 176.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 68.28 -176.21 0.2 Allowed 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.908 0.883 . . . . 0.0 112.048 176.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.17 -41.68 2.16 Favored Glycine 0 C--N 1.297 -1.599 0 C-N-CA 121.208 -0.52 . . . . 0.0 111.805 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.63 -64.52 3.83 Favored Glycine 0 C--N 1.301 -1.405 0 C-N-CA 121.329 -0.462 . . . . 0.0 112.285 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.27 -40.24 81.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.053 0.541 . . . . 0.0 111.093 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.87 -36.17 82.42 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.649 0.738 . . . . 0.0 109.178 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -72.4 -41.2 66.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.698 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 29.0 tpt180 -56.34 -50.16 72.28 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.052 -0.977 . . . . 0.0 108.949 176.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -59.01 -42.24 89.65 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.304 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 m -54.3 -54.99 32.79 Favored 'General case' 0 C--O 1.215 -0.742 0 O-C-N 123.674 0.609 . . . . 0.0 112.021 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.78 -33.64 75.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 14.0 mm100 -62.12 -49.75 74.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -70.88 -29.62 65.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.518 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.2 t -63.79 -51.69 63.63 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.423 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.55 -25.31 62.16 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.66 -42.38 95.44 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -68.47 -37.93 80.59 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.925 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 53.5 tp . . . . . 0 C--O 1.24 0.584 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.204 176.49 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 6' ' ' ILE . 98.8 mttt . . . . . 0 N--CA 1.445 -0.702 0 CA-C-O 120.562 0.22 . . . . 0.0 111.32 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -68.86 -32.74 72.62 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.9 m -64.88 -43.79 91.79 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.077 -1.42 . . . . 0.0 109.554 176.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.44 -43.76 93.29 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.274 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.4 mt -61.55 -50.39 80.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 t -51.52 -43.53 62.31 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.008 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -72.91 -46.48 52.4 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.222 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -59.14 -41.89 89.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -174.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 78.6 t90 -55.5 -48.38 74.7 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.609 0.568 . . . . 0.0 110.327 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -77.65 -30.02 51.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.733 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -67.45 -41.39 84.79 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.963 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.1 p -84.02 -20.68 8.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-O 121.176 0.513 . . . . 0.0 110.01 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 22.4 ttt -60.95 -54.49 44.32 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -153.62 101.12 2.55 Favored Pre-proline 0 N--CA 1.428 -1.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.977 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.29 119.64 6.89 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.96 1.773 . . . . 0.0 108.978 173.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 59.53 74.6 0.44 Allowed 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 111.398 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -105.54 164.14 14.04 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.8 -92.15 2.07 Favored Glycine 0 N--CA 1.425 -2.06 0 C-N-CA 120.87 -0.681 . . . . 0.0 111.992 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.56 -46.87 83.94 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.452 0.701 . . . . 0.0 111.75 -174.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -65.36 -38.32 89.71 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 120.789 0.328 . . . . 0.0 111.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.449 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 26.3 tt0 -70.45 -32.9 70.65 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -64.2 -42.19 96.74 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -57.68 -48.17 80.26 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.485 174.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.3 m -55.74 -40.69 72.86 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.72 178.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.506 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 78.1 mt-30 -57.34 -51.22 70.29 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 123.349 0.405 . . . . 0.0 109.991 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.54 -49.56 73.0 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.052 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.34 -47.94 83.87 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.06 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.7 t -63.02 -42.75 99.88 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 122.941 0.15 . . . . 0.0 110.985 -175.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 49.1 mt-10 -64.7 -39.96 94.55 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.953 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -87.15 -29.29 21.91 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.286 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -80.52 -44.46 19.07 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.104 0.478 . . . . 0.0 110.617 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.1 tp . . . . . 0 C--N 1.307 -1.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.219 -179.44 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 86.5 tttt . . . . . 0 N--CA 1.443 -0.798 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.25 -26.45 67.36 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.338 0.589 . . . . 0.0 110.699 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.1 m -70.48 -47.88 58.44 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.372 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -62.67 -49.36 75.44 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.776 -177.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.11 -53.33 44.64 Favored 'Isoleucine or valine' 0 C--O 1.245 0.833 0 CA-C-O 121.619 0.723 . . . . 0.0 109.662 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.25 -49.26 77.73 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.372 -1.285 . . . . 0.0 112.253 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -67.51 -41.56 84.25 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -56.57 -36.79 69.75 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 123.312 0.382 . . . . 0.0 110.614 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -59.66 -49.87 76.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.9 m -74.21 -27.34 60.74 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.924 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -69.62 -43.6 72.37 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.4 p -78.16 -20.46 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.338 0.589 . . . . 0.0 109.837 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 47.8 tpp -71.15 -49.38 44.55 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.688 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -151.88 107.88 2.86 Favored Pre-proline 0 N--CA 1.43 -1.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.311 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -57.58 139.78 91.3 Favored 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.704 2.269 . . . . 0.0 109.566 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 68.13 -67.21 0.2 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.683 1.193 . . . . 0.0 109.944 -172.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.432 ' HA3' ' HB2' ' A' ' 22' ' ' GLN . . . 87.71 -52.87 4.26 Favored Glycine 0 N--CA 1.436 -1.306 0 CA-C-N 116.578 -0.283 . . . . 0.0 112.919 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.39 -114.84 6.58 Favored Glycine 0 C--N 1.308 -1.009 0 N-CA-C 110.494 -1.043 . . . . 0.0 110.494 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -67.4 -29.04 68.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 117.153 0.477 . . . . 0.0 110.371 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.94 -31.37 66.27 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.158 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.432 ' HB2' ' HA3' ' A' ' 18' ' ' GLY . 4.4 tp-100 -76.17 -36.86 58.5 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.551 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 68.7 mtt180 -65.61 -39.36 91.45 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.298 176.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -64.42 -43.76 93.35 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.1 m -60.32 -39.52 87.34 Favored 'General case' 0 C--O 1.2 -1.503 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.403 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -58.22 -46.2 86.31 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.296 0.638 . . . . 0.0 109.973 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 23' ' ' ARG . 18.8 mt-30 -55.73 -52.87 62.42 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.802 0.689 . . . . 0.0 109.612 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -65.89 -39.6 90.79 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.357 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 t -65.42 -43.46 90.42 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 122.905 0.482 . . . . 0.0 110.263 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -62.85 -47.1 84.82 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.832 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.49 -38.32 86.87 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.456 0.702 . . . . 0.0 110.979 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -63.47 -45.42 90.89 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 123.813 0.845 . . . . 0.0 110.317 175.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.1 tp . . . . . 0 C--N 1.315 -0.928 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.439 -177.454 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.441 ' HB2' ' HZ3' ' A' ' 2' ' ' LYS . 10.1 mtmp? . . . . . 0 CA--C 1.515 -0.392 0 CA-C-O 121.747 0.784 . . . . 0.0 108.946 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . 0.513 ' H ' ' CD ' ' A' ' 3' ' ' GLU . 2.1 mp0 -54.25 -52.38 61.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 125.864 1.666 . . . . 0.0 109.574 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 p -72.85 -34.92 67.09 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 113.197 -1.819 . . . . 0.0 111.824 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.14 -52.27 66.44 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 122.593 0.357 . . . . 0.0 110.464 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 78.0 mt -60.88 -50.78 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.5 t -52.98 -47.0 68.51 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 114.131 -1.395 . . . . 0.0 111.18 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -61.92 -48.29 81.08 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 123.863 0.865 . . . . 0.0 110.529 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -61.72 -37.5 84.42 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.925 0.765 . . . . 0.0 111.686 -175.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -56.71 -53.04 62.31 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 121.477 0.656 . . . . 0.0 109.738 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.7 m -66.66 -37.61 85.14 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -64.79 -44.3 90.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.394 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.5 p -73.16 -29.86 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.156 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 17.2 tpt -69.42 -54.66 13.25 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.511 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -148.87 108.11 3.47 Favored Pre-proline 0 C--N 1.321 -0.672 0 C-N-CA 123.751 0.82 . . . . 0.0 109.604 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -66.5 119.45 6.48 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 121.82 1.68 . . . . 0.0 111.668 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 51.11 -95.43 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 126.177 1.791 . . . . 0.0 114.272 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.48 -115.24 5.55 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -161.88 -80.61 0.04 OUTLIER Glycine 0 N--CA 1.415 -2.712 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.0 -31.86 73.3 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -70.75 -41.07 72.28 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.66 -37.92 65.13 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.481 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.463 ' HD3' ' OE1' ' A' ' 26' ' ' GLN . 39.9 mmt180 -63.93 -41.04 97.74 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.424 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 51.0 ttp180 -63.68 -46.7 84.36 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 43.9 m -57.89 -34.48 69.84 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.463 ' OE1' ' HD3' ' A' ' 23' ' ' ARG . 54.6 mt-30 -60.64 -49.63 76.74 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.364 0.529 . . . . 0.0 110.355 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -62.41 -46.79 86.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.474 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.581 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 23.2 mm-40 -63.3 -46.91 84.53 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.191 0.596 . . . . 0.0 111.689 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 10.5 t -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 122.774 0.43 . . . . 0.0 111.0 -175.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.15 -25.09 61.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.604 -0.439 . . . . 0.0 110.656 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.31 -39.58 85.91 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 174.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 13.1 mmt180 -67.6 -38.08 83.49 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.55 176.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.9 tp . . . . . 0 C--N 1.309 -1.168 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.729 -179.807 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.3 mttt . . . . . 0 C--O 1.252 1.2 0 CA-C-O 120.954 0.407 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -79.05 -13.61 59.66 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.768 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.7 m -65.54 -45.17 84.42 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -59.25 -47.27 85.99 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.203 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.2 -54.88 26.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.072 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.3 t -54.98 -48.74 72.89 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.418 -1.264 . . . . 0.0 111.796 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -66.95 -46.96 73.12 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.118 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.401 ' O ' HG23 ' A' ' 13' ' ' VAL . 6.8 tp60 -57.46 -38.52 74.61 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.594 0.559 . . . . 0.0 110.584 -177.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -54.94 -54.93 36.44 Favored 'General case' 0 C--O 1.249 1.057 0 C-N-CA 123.666 0.786 . . . . 0.0 110.746 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.4 m -70.8 -36.22 72.9 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.075 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -61.33 -39.33 90.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.814 0.846 . . . . 0.0 111.547 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 9' ' ' GLN . 34.1 m -83.14 -30.87 8.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 61.0 mtm -77.83 -54.09 6.74 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 119.368 -0.933 . . . . 0.0 111.9 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -156.7 91.37 2.52 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.0 128.74 8.54 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.26 1.973 . . . . 0.0 113.036 -177.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 69.22 127.14 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.924 1.29 . . . . 0.0 113.678 175.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -177.56 164.17 33.11 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 109.234 -1.547 . . . . 0.0 109.234 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.33 -86.87 0.28 Allowed Glycine 0 N--CA 1.438 -1.222 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.351 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.532 ' OE2' ' HD3' ' A' ' 23' ' ' ARG . 5.9 tp10 -70.35 -33.12 71.09 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -178.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.11 -60.21 4.09 Favored 'General case' 0 C--O 1.245 0.859 0 C-N-CA 123.895 0.878 . . . . 0.0 110.922 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 56.2 tp60 -72.39 -23.83 61.16 Favored 'General case' 0 C--O 1.2 -1.549 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.019 -177.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.532 ' HD3' ' OE2' ' A' ' 20' ' ' GLU . 33.6 ttt180 -62.8 -33.96 76.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -63.09 -48.7 77.48 Favored 'General case' 0 CA--C 1.502 -0.878 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 175.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.9 m -58.75 -38.45 78.44 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.211 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 14.2 mm100 -61.38 -48.86 79.34 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 177.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.473 ' O ' ' HB2' ' A' ' 31' ' ' GLU . 24.8 mt-30 -63.4 -43.77 96.58 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.9 0.381 . . . . 0.0 111.586 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.662 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 6.8 mm-40 -67.48 -53.32 29.76 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.156 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.5 t -67.3 -51.95 46.37 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.192 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.82 -26.76 64.4 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -174.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -79.42 -27.51 41.76 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.016 176.699 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.662 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 34.3 mtm180 -81.44 -38.89 25.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.263 0.554 . . . . 0.0 110.206 178.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.4 mt . . . . . 0 C--N 1.309 -1.182 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.857 179.55 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.428 ' O ' HG13 ' A' ' 6' ' ' ILE . 66.3 mttm . . . . . 0 CA--C 1.509 -0.616 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.95 -41.12 82.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.447 0.641 . . . . 0.0 109.415 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.2 m -58.76 -42.83 89.8 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.253 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.38 -45.25 91.94 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.496 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 2' ' ' LYS . 58.6 mt -63.99 -50.48 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.908 0.861 . . . . 0.0 108.741 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.0 t -52.8 -45.91 67.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.864 -1.516 . . . . 0.0 112.414 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -30.81 51.65 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.526 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.507 ' O ' HG21 ' A' ' 13' ' ' VAL . 23.2 tp60 -60.2 -42.85 95.97 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 90.8 t90 -55.72 -43.84 76.91 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 123.649 0.78 . . . . 0.0 109.849 177.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.4 m -68.97 -36.71 78.2 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.65 -28.73 70.11 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 120.964 0.411 . . . . 0.0 111.334 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.507 HG21 ' O ' ' A' ' 9' ' ' GLN . 88.0 t -75.24 -38.97 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 121.446 0.641 . . . . 0.0 109.347 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.3 ttt -68.62 -54.66 15.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.737 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -156.46 101.59 2.04 Favored Pre-proline 0 C--N 1.307 -1.28 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -57.91 118.72 5.65 Favored 'Trans proline' 0 C--O 1.252 1.195 0 C-N-CA 122.406 2.071 . . . . 0.0 111.202 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 53.88 51.85 14.05 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.259 0.974 . . . . 0.0 110.405 -177.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.96 164.58 51.6 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.898 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.36 -95.92 0.3 Allowed Glycine 0 N--CA 1.432 -1.627 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -69.45 -26.21 64.48 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.648 -178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -59.22 -56.88 16.54 Favored 'General case' 0 C--O 1.217 -0.606 0 O-C-N 123.546 0.529 . . . . 0.0 110.656 176.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -67.24 -29.73 69.44 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -176.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 25.5 mmm180 -63.98 -56.61 13.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.352 174.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -59.73 -40.79 89.23 Favored 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 123.414 0.447 . . . . 0.0 109.812 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 21.9 m -49.81 -56.95 8.44 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 124.243 0.964 . . . . 0.0 111.052 173.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -65.78 -33.93 77.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 15.6 mm100 -57.96 -51.01 71.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.261 0.351 . . . . 0.0 111.174 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.35 -29.45 42.23 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.979 0.418 . . . . 0.0 111.163 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.621 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.6 t -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.417 0.687 . . . . 0.0 109.21 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -74.07 -28.06 61.2 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.434 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 14.8 tp10 -61.4 -46.24 91.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.019 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -74.39 -33.3 63.0 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.515 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.6 tp . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.441 -179.208 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 57.1 tptt . . . . . 0 N--CA 1.439 -1.021 0 CA-C-O 120.882 0.373 . . . . 0.0 110.656 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.98 -31.61 69.39 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.37 -178.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -64.47 -49.0 73.14 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.819 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 9' ' ' GLN . 8.3 tp10 -60.89 -48.97 79.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.215 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 82.6 mt -55.72 -52.91 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 CA-C-O 121.29 0.567 . . . . 0.0 109.667 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.9 t -52.39 -47.05 66.44 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.665 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -68.72 -35.72 77.51 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.614 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 5' ' ' GLU . 57.4 mt-30 -57.9 -37.67 74.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 118.158 0.435 . . . . 0.0 111.111 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.51 -50.62 73.09 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.057 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 m -82.04 -13.2 57.69 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -67.9 -34.18 76.14 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.7 t -79.6 -39.72 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.252 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.3 mmt -68.35 -55.23 12.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -136.6 87.04 21.59 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-O 120.871 0.367 . . . . 0.0 111.144 -176.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -88.49 120.15 1.2 Allowed 'Trans proline' 0 N--CA 1.443 -1.489 0 C-N-CA 122.643 2.229 . . . . 0.0 110.476 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 64.55 90.59 0.08 Allowed 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.872 1.269 . . . . 0.0 111.546 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.91 -173.17 20.68 Favored Glycine 0 N--CA 1.434 -1.447 0 C-N-CA 120.186 -1.006 . . . . 0.0 112.216 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.0 -96.25 2.24 Favored Glycine 0 N--CA 1.429 -1.801 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -63.34 -41.44 98.87 Favored 'General case' 0 C--O 1.207 -1.162 0 C-N-CA 122.979 0.512 . . . . 0.0 111.126 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -66.64 -32.56 73.95 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.265 0.555 . . . . 0.0 111.161 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -76.21 -37.93 57.13 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -64.58 -38.98 92.88 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.876 175.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -54.99 -52.22 63.77 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 m -64.97 -33.51 76.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.037 177.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.28 -48.85 63.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -61.03 -45.3 95.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.156 0.582 . . . . 0.0 109.607 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -53.23 -47.2 69.2 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.809 173.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.2 t -70.57 -41.01 72.98 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.277 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -60.7 -45.04 95.7 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.954 0.407 . . . . 0.0 110.52 177.972 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -68.57 -22.45 64.47 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.643 0.735 . . . . 0.0 110.941 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -87.88 -34.76 18.07 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.546 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.8 tp . . . . . 0 C--N 1.31 -1.149 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.679 179.053 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -61.24 -46.84 88.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.81 0.814 . . . . 0.0 110.398 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.0 m -74.51 -23.27 58.81 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.585 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.4 -51.01 61.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.772 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.27 -32.64 56.61 Favored 'Isoleucine or valine' 0 C--O 1.251 1.175 0 CA-C-O 121.492 0.663 . . . . 0.0 109.329 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.12 -48.17 82.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.797 175.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.2 ttt180 -64.86 -40.99 96.01 Favored 'General case' 0 C--O 1.213 -0.858 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -50.33 -37.38 36.42 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.524 1.13 . . . . 0.0 111.706 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.7 t90 -57.93 -49.18 77.63 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 121.744 0.783 . . . . 0.0 109.766 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.5 m -78.77 -31.06 45.96 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.195 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -63.6 -43.9 95.56 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 123.786 0.835 . . . . 0.0 109.932 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 p -78.14 -29.74 15.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.409 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.9 ttp -60.93 -55.1 36.99 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -157.12 108.05 1.9 Allowed Pre-proline 0 N--CA 1.439 -0.999 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.5 119.85 7.05 Favored 'Trans proline' 0 C--O 1.25 1.116 0 C-N-CA 122.121 1.881 . . . . 0.0 111.471 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 69.46 173.35 0.3 Allowed 'General case' 0 C--O 1.252 1.208 0 C-N-CA 124.51 1.124 . . . . 0.0 112.507 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 155.36 166.67 15.86 Favored Glycine 0 N--CA 1.421 -2.312 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 177.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.94 -87.79 1.06 Allowed Glycine 0 C--N 1.295 -1.731 0 C-N-CA 119.872 -1.156 . . . . 0.0 110.692 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 24' ' ' ARG . 39.0 mt-10 -67.96 -37.17 81.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.929 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.95 -42.18 72.0 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 123.648 0.592 . . . . 0.0 110.394 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -71.55 -38.62 70.98 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.727 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -68.09 -33.94 75.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.161 0.505 . . . . 0.0 109.966 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 91.8 mtt180 -65.48 -54.48 27.7 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.595 177.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.02 -37.27 74.01 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -59.01 -51.55 69.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 177.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -63.4 -46.73 85.06 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.52 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 32.7 mm-40 -55.22 -47.52 75.2 Favored 'General case' 0 C--O 1.217 -0.612 0 O-C-N 123.59 0.556 . . . . 0.0 110.645 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.7 t -59.45 -44.18 93.0 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.584 -178.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.12 -40.14 86.78 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.89 -30.58 61.34 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.5 mtt180 -73.2 -43.62 61.04 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.1 tp . . . . . 0 C--N 1.315 -0.929 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.081 176.053 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -69.16 -30.08 68.24 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 121.641 0.734 . . . . 0.0 110.015 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' THR . . . . . 0.417 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 26.4 m -78.35 -32.95 49.32 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.234 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.501 ' HG2' ' NE2' ' A' ' 9' ' ' GLN . 36.2 tt0 -63.1 -52.24 63.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.799 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.8 pt -66.17 -33.87 66.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.237 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 4' ' ' THR . 38.1 t -52.45 -47.58 66.35 Favored 'General case' 0 C--O 1.245 0.823 0 O-C-N 123.88 0.738 . . . . 0.0 111.041 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -78.39 -41.85 32.0 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.369 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.501 ' NE2' ' HG2' ' A' ' 5' ' ' GLU . 49.6 mt-30 -56.96 -41.25 78.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.219 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -59.02 -51.6 69.38 Favored 'General case' 0 N--CA 1.443 -0.779 0 O-C-N 123.757 0.661 . . . . 0.0 109.263 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.9 m -64.31 -39.58 94.19 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.369 178.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.46 -45.4 93.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.057 0.456 . . . . 0.0 111.217 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 88.0 t -77.0 -45.86 30.0 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.401 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 16.3 tpt -70.02 -49.49 50.81 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.869 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.429 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 16.5 ptpt -130.56 79.7 71.63 Favored Pre-proline 0 C--N 1.308 -1.216 0 CA-C-O 121.734 0.778 . . . . 0.0 112.015 -175.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -82.94 120.66 3.06 Favored 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 122.87 2.38 . . . . 0.0 111.732 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 69.23 99.95 0.06 Allowed 'General case' 0 C--O 1.241 0.623 0 C-N-CA 124.989 1.316 . . . . 0.0 111.735 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -158.82 167.77 34.82 Favored Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 178.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.02 -90.95 1.63 Allowed Glycine 0 N--CA 1.431 -1.692 0 C-N-CA 120.382 -0.914 . . . . 0.0 111.384 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -64.42 -31.45 72.67 Favored 'General case' 0 C--O 1.214 -0.799 0 C-N-CA 122.33 0.252 . . . . 0.0 111.667 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.429 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 67.5 mm-40 -60.88 -50.81 71.93 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 120.809 0.338 . . . . 0.0 111.573 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -75.18 -32.86 61.37 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.967 0.413 . . . . 0.0 109.933 -178.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.03 -42.03 98.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.318 0.58 . . . . 0.0 109.595 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -63.35 -44.12 95.74 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.826 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 28.7 m -55.95 -47.12 78.18 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.454 0.471 . . . . 0.0 110.781 174.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -55.21 -56.67 17.32 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.52 0.513 . . . . 0.0 111.082 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -60.81 -46.72 89.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.356 -176.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -63.14 -41.44 99.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.208 0.527 . . . . 0.0 110.445 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.4 t -65.68 -45.35 83.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.09 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.66 -27.97 62.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.207 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -71.67 -36.39 70.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -70.28 -38.02 74.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.7 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.2 tp . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.692 179.585 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 CA--C 1.506 -0.736 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.65 -30.62 70.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.345 0.593 . . . . 0.0 110.059 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.4 m -69.78 -36.55 75.83 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.561 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.59 -50.49 67.01 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.835 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.34 -50.42 80.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.932 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.9 t -50.47 -44.47 55.72 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.201 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -74.62 -48.82 24.25 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.975 177.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -54.7 -39.5 68.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.321 0.648 . . . . 0.0 111.99 -176.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 77.9 t90 -55.07 -52.97 61.52 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 123.78 0.675 . . . . 0.0 110.182 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -75.94 -32.21 59.45 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -56.63 -46.71 80.81 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.623 0.769 . . . . 0.0 110.602 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -86.01 -38.9 13.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.403 -177.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 15.1 tpt -62.23 -40.4 96.02 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.804 0.335 . . . . 0.0 111.624 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -127.3 108.84 21.31 Favored Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.075 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -54.91 158.59 10.85 Favored 'Trans proline' 0 C--O 1.25 1.101 0 C-N-CA 122.938 2.425 . . . . 0.0 111.261 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -63.81 112.51 2.92 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.505 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -128.67 -91.96 0.69 Allowed Glycine 0 N--CA 1.426 -1.968 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.03 -80.47 0.04 OUTLIER Glycine 0 C--N 1.302 -1.346 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.936 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 24' ' ' ARG . 3.7 mp0 -57.52 -39.65 77.02 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 123.061 0.545 . . . . 0.0 110.769 -176.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -50.42 -54.95 18.13 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 124.632 1.173 . . . . 0.0 110.304 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -67.83 -37.98 82.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.531 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -61.24 -47.49 85.83 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.403 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 75.2 mtp180 -63.34 -46.67 85.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.004 178.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.2 m -62.25 -31.81 72.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -66.67 -43.75 83.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -64.59 -48.71 73.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.087 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 60.3 mm-40 -59.46 -43.72 93.13 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.958 177.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -59.6 -57.82 11.26 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.492 0.495 . . . . 0.0 110.74 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -57.7 -39.93 78.32 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.57 -43.31 97.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.647 -178.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 51.0 mtt180 -89.42 -28.69 19.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.656 -175.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.2 tp . . . . . 0 C--N 1.308 -1.22 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.168 -179.779 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 120.631 0.253 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.52 -31.45 72.18 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.975 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.0 m -72.07 -36.46 69.56 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -67.69 -52.93 32.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.645 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.54 -38.07 81.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.3 t -58.74 -42.94 89.97 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.877 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -75.71 -45.24 37.82 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.909 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.74 -31.83 72.84 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -59.85 -49.17 78.75 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 70.2 m -66.67 -43.57 84.14 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.762 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -59.29 -42.41 91.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.968 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.7 m -86.11 -19.64 8.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.35 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.2 ttt -75.08 -47.94 26.34 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.307 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -156.37 99.07 2.12 Favored Pre-proline 0 N--CA 1.438 -1.059 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.123 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -85.66 120.08 2.01 Favored 'Trans proline' 0 N--CA 1.451 -1.02 0 C-N-CA 122.609 2.206 . . . . 0.0 110.549 176.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -164.59 -51.6 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.31 0.576 . . . . 0.0 110.635 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.407 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 105.49 -137.06 13.54 Favored Glycine 0 N--CA 1.416 -2.658 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 -174.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.541 ' O ' ' HG2' ' A' ' 23' ' ' ARG . . . 55.58 -135.99 47.65 Favored Glycine 0 C--O 1.246 0.898 0 O-C-N 123.934 0.432 . . . . 0.0 113.71 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.37 -30.11 63.07 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 122.693 0.397 . . . . 0.0 110.591 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -58.92 -43.85 91.19 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.954 0.883 . . . . 0.0 108.717 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.407 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 9.6 tt0 -69.96 -39.02 76.26 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.45 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 19' ' ' GLY . 30.9 mmm180 -61.8 -44.18 97.37 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 34.9 mmt180 -61.65 -49.67 75.6 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.529 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 24.6 m -62.13 -37.31 84.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 177.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -57.67 -52.98 63.2 Favored 'General case' 0 C--O 1.245 0.821 0 C-N-CA 122.935 0.494 . . . . 0.0 110.5 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -55.56 -58.86 6.05 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.486 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.8 pt-20 -66.68 -33.69 76.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.273 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 10.1 t -65.54 -52.53 51.74 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.365 0.126 . . . . 0.0 110.704 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -72.39 -25.93 61.69 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.38 -42.68 64.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -67.94 -37.76 82.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.119 177.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.5 tp . . . . . 0 C--N 1.31 -1.148 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.766 179.964 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt . . . . . 0 N--CA 1.446 -0.631 0 CA-C-O 120.749 0.309 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.73 -27.35 61.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 121.598 0.713 . . . . 0.0 110.974 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 m -74.7 -33.49 62.44 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.796 178.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -62.63 -47.74 82.4 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.04 176.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.7 -47.85 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.572 176.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.5 t -46.98 -46.58 21.73 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.944 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -70.22 -45.67 66.07 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.38 176.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -56.0 -35.15 66.48 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.288 0.367 . . . . 0.0 111.818 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -60.97 -55.41 33.29 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.071 0.462 . . . . 0.0 110.035 176.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.25 -32.56 72.84 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.518 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -57.28 -48.82 77.91 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 123.554 0.742 . . . . 0.0 110.631 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.7 t -79.53 -39.63 20.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.321 -0.854 . . . . 0.0 112.268 -176.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 60.0 mtt -84.0 -27.51 28.36 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -175.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.467 ' CG ' ' HB3' ' A' ' 21' ' ' GLU . 4.7 mptp? -108.91 107.35 59.96 Favored Pre-proline 0 C--N 1.308 -1.231 0 O-C-N 122.249 -0.282 . . . . 0.0 110.296 -177.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.56 121.19 8.68 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 123.507 2.805 . . . . 0.0 113.335 -178.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 68.3 -66.72 0.22 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.004 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 155.2 -120.95 1.05 Allowed Glycine 0 N--CA 1.424 -2.128 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.783 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.6 -143.98 26.25 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -56.2 -32.5 64.44 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.019 0.438 . . . . 0.0 111.214 177.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.467 ' HB3' ' CG ' ' A' ' 15' ' ' LYS . 33.1 mm-40 -61.61 -40.69 95.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.672 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -76.78 -34.45 58.0 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.594 -178.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.71 -50.64 71.62 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.249 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.8 ttt180 -59.9 -45.76 91.49 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.158 177.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 31.5 m -59.27 -39.8 84.06 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.469 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 50.1 tt0 -62.29 -49.17 76.71 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.02 -52.48 63.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.766 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -68.21 -29.03 67.77 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.3 t -71.94 -43.56 65.05 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 58.8 mt-10 -68.79 -32.65 72.53 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.66 -38.34 83.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.657 0.741 . . . . 0.0 109.528 177.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -79.04 -34.05 44.18 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.961 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.9 tp . . . . . 0 C--N 1.311 -1.102 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.286 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 6' ' ' ILE . 67.0 mttm . . . . . 0 N--CA 1.431 -1.409 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.57 -40.2 80.66 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-O 121.635 0.731 . . . . 0.0 109.628 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 m -75.07 -32.6 61.54 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-N 114.383 -1.281 . . . . 0.0 108.886 178.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -58.94 -52.1 67.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.103 177.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.6 mt -57.93 -48.14 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.4 t -49.44 -53.8 20.97 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-N 114.148 -1.387 . . . . 0.0 111.916 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.05 -37.98 69.58 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.453 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -56.12 -41.21 74.92 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.866 0.466 . . . . 0.0 110.302 -179.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -60.76 -46.61 89.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.793 178.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.7 m -71.26 -30.61 66.51 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -64.91 -32.34 74.0 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.672 0.748 . . . . 0.0 109.929 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.4 t -85.71 -46.65 16.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.762 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.4 mmt -74.42 -39.29 62.71 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -176.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.438 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 64.7 mttm -131.3 74.61 78.78 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 122.872 0.469 . . . . 0.0 109.905 -177.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -87.58 120.18 1.44 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.688 2.259 . . . . 0.0 112.514 -176.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 63.82 -176.6 0.16 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.454 1.102 . . . . 0.0 111.655 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.65 -97.41 0.93 Allowed Glycine 0 C--N 1.29 -1.986 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . 0.49 ' O ' ' HG3' ' A' ' 23' ' ' ARG . . . 176.5 -91.6 0.08 OUTLIER Glycine 0 N--CA 1.426 -1.998 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.298 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.88 -45.09 70.96 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 -173.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.438 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 28.4 mm-40 -67.72 -35.57 79.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.048 0.451 . . . . 0.0 111.415 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.62 -38.93 70.74 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.158 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 19' ' ' GLY . 73.7 mtp180 -61.26 -42.79 99.23 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.966 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -61.83 -42.55 99.17 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.288 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.43 ' SG ' ' HD2' ' A' ' 15' ' ' LYS . 1.8 m -64.74 -34.92 79.45 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.425 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 34.8 tt0 -63.31 -50.6 69.4 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.12 -49.31 78.15 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.975 178.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -53.01 -49.44 66.22 Favored 'General case' 0 CA--C 1.498 -1.034 0 C-N-CA 123.891 0.876 . . . . 0.0 112.881 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 5.9 t -68.0 -34.48 76.6 Favored 'General case' 0 C--N 1.308 -1.225 0 O-C-N 123.55 0.531 . . . . 0.0 110.607 -175.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 12.2 mm-40 -68.85 -38.96 80.14 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.792 178.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -76.13 -18.76 59.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.989 0.423 . . . . 0.0 110.991 178.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -85.55 -54.58 4.47 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.199 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 C--N 1.317 -0.841 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.706 -178.26 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 5' ' ' GLU . 74.0 mmtt . . . . . 0 N--CA 1.44 -0.93 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -78.48 -26.62 46.08 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.124 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.6 m -72.27 -32.34 66.55 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.397 175.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.46 ' HB3' ' O ' ' A' ' 2' ' ' LYS . 13.3 tp10 -62.06 -52.15 65.08 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.875 175.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 2' ' ' LYS . 61.2 mt -58.01 -50.41 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 121.396 0.617 . . . . 0.0 109.553 178.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.0 t -54.12 -48.17 71.04 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.346 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -69.92 -39.24 76.26 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.099 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -58.38 -38.62 77.67 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 178.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . 0.418 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 82.9 t90 -59.18 -55.06 39.76 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' HE3' ' A' ' 10' ' ' TRP . 96.4 m -67.41 -34.07 76.48 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -58.8 -45.88 88.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.031 0.443 . . . . 0.0 110.597 178.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.8 p -82.17 -35.16 12.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.178 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.52 -47.94 57.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.008 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -126.79 96.09 35.96 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.353 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -64.51 141.17 72.53 Favored 'Trans proline' 0 C--O 1.244 0.792 0 C-N-CA 122.157 1.905 . . . . 0.0 110.061 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 75.67 -53.44 0.63 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.417 1.487 . . . . 0.0 110.758 -176.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.6 -78.79 0.33 Allowed Glycine 0 N--CA 1.43 -1.766 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.213 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.05 -119.22 12.71 Favored Glycine 0 C--N 1.307 -1.083 0 N-CA-C 112.058 -0.417 . . . . 0.0 112.058 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -66.85 -34.13 77.12 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.79 0.805 . . . . 0.0 109.036 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.66 -18.53 60.52 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.646 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.7 tm0? -67.4 -45.53 75.88 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -59.81 -48.98 79.51 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 124.152 0.908 . . . . 0.0 109.584 178.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . 0.542 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 71.7 ttt180 -57.66 -56.87 16.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.482 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 10.7 m -57.36 -44.58 84.48 Favored 'General case' 0 C--O 1.204 -1.293 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 36.0 tt0 -63.47 -40.66 97.71 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -64.65 -44.65 89.77 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.564 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.0 mm-40 -71.77 -29.52 64.57 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.071 0.462 . . . . 0.0 110.066 179.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.2 t -69.6 -47.6 62.96 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.079 -177.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 10.0 pt-20 -67.26 -27.3 67.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.988 0.423 . . . . 0.0 110.618 177.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.23 -46.04 71.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.477 174.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -64.95 -33.88 77.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.903 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp . . . . . 0 C--N 1.311 -1.079 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.203 178.038 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 55.7 mttp . . . . . 0 N--CA 1.453 -0.321 0 CA-C-O 121.359 0.6 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -70.13 -26.91 64.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.433 0.635 . . . . 0.0 111.036 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.7 m -74.97 -30.67 61.26 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.907 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -65.98 -42.44 89.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.547 176.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.8 mt -62.42 -46.35 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -54.52 -44.37 72.7 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.454 -1.248 . . . . 0.0 110.695 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -68.91 -41.57 78.04 Favored 'General case' 0 C--O 1.216 -0.7 0 O-C-N 122.175 -0.328 . . . . 0.0 110.412 175.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . 0.449 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.3 tt0 -57.11 -40.64 77.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 123.556 0.742 . . . . 0.0 111.807 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -60.44 -50.43 73.63 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 123.473 0.483 . . . . 0.0 110.195 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.75 -30.34 67.91 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.2 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 8.3 tt0 -55.74 -46.59 77.76 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.002 0.921 . . . . 0.0 110.146 177.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.0 t -83.29 -29.66 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.189 -178.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.0 ttt -61.72 -53.06 61.2 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.053 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -148.3 94.28 4.25 Favored Pre-proline 0 N--CA 1.436 -1.169 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.664 -177.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -72.86 122.05 7.84 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 122.61 2.206 . . . . 0.0 110.805 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 65.1 19.18 11.74 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 176.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -92.62 95.86 2.06 Favored Glycine 0 CA--C 1.491 -1.457 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -43.49 -51.59 6.53 Favored Glycine 0 C--O 1.22 -0.758 0 O-C-N 124.856 0.974 . . . . 0.0 115.394 -172.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.07 -45.62 69.87 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 117.218 0.509 . . . . 0.0 112.073 -175.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -69.29 -42.14 75.86 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.753 0.787 . . . . 0.0 109.558 -175.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -69.76 -35.57 75.04 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.383 -1.281 . . . . 0.0 109.643 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.4 ttt180 -68.23 -39.82 82.21 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 177.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -62.57 -42.72 99.72 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.779 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.9 m -58.22 -45.26 88.01 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.463 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -53.98 -53.77 48.21 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -62.13 -51.08 69.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.112 -178.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -69.78 -42.71 73.43 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -176.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.8 t -63.77 -38.68 92.01 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.687 0.279 . . . . 0.0 110.491 -177.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -76.08 -33.87 59.53 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.526 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -68.14 -38.51 82.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.646 0.736 . . . . 0.0 109.459 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . 0.438 ' HA ' ' NE ' ' A' ' 32' ' ' ARG . 4.6 tpm_? -67.32 -36.21 81.01 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.743 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.7 tp . . . . . 0 C--N 1.307 -1.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.129 -177.29 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 93.5 mttt . . . . . 0 N--CA 1.449 -0.519 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.63 -37.74 88.46 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.646 -179.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.84 -46.46 81.81 Favored 'General case' 0 C--N 1.282 -2.334 0 CA-C-N 113.847 -1.524 . . . . 0.0 109.135 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -64.03 -51.89 62.02 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.56 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 pt -62.91 -39.15 83.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.6 t -61.69 -32.98 73.21 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-O 120.943 0.402 . . . . 0.0 109.923 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -71.56 -48.5 48.13 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 174.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -54.25 -43.84 71.28 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.639 0.587 . . . . 0.0 111.145 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -52.08 -49.02 64.36 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.838 0.711 . . . . 0.0 111.727 177.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.2 m -80.29 -23.83 40.43 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 178.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 -71.26 -32.72 69.06 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -82.0 -34.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.31 -55.14 35.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.828 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -146.45 87.46 6.48 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.8 120.28 7.29 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 121.827 1.685 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 63.97 32.54 13.0 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.336 0.654 . . . . 0.0 110.381 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.44 168.29 54.51 Favored Glycine 0 N--CA 1.437 -1.28 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.042 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.58 -92.32 2.11 Favored Glycine 0 N--CA 1.421 -2.311 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -51.28 -51.7 51.79 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 124.367 1.067 . . . . 0.0 110.846 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.17 -35.27 77.78 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.803 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -76.2 -36.0 58.82 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.391 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -61.76 -43.92 97.9 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -56.94 -51.2 70.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.767 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 m -55.49 -39.58 70.61 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.54 -54.01 50.57 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -61.17 -42.8 99.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.769 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.2 -43.81 81.2 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 177.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.1 t -67.38 -45.89 74.92 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.432 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -68.09 -27.89 66.87 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.097 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -75.73 -34.05 60.31 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.136 0.494 . . . . 0.0 110.09 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -76.28 -53.35 8.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.242 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 C--N 1.322 -0.614 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.748 -178.38 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.68 0 CA-C-O 121.455 0.645 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -73.96 -45.92 47.18 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.906 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.91 -29.62 66.84 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.147 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.0 m -61.58 -40.02 93.25 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.819 178.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -50.39 68.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.165 177.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 53.0 mt -58.18 -52.07 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-O 121.323 0.582 . . . . 0.0 109.977 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.2 t -52.17 -44.7 64.78 Favored 'General case' 0 C--O 1.248 0.99 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.89 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.2 -38.42 31.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.881 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.53 -30.28 71.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -176.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -57.56 -51.73 68.28 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.8 m -65.91 -30.18 70.72 Favored 'General case' 0 C--O 1.192 -1.949 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.893 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.47 -29.24 69.32 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.106 0.479 . . . . 0.0 110.197 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -87.08 -47.07 16.14 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.291 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.5 tpt -71.61 -42.01 68.22 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -136.35 83.84 30.8 Favored Pre-proline 0 C--N 1.312 -1.04 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.71 119.12 4.7 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.422 2.082 . . . . 0.0 112.583 -176.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 46.61 75.87 0.11 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.654 1.182 . . . . 0.0 113.292 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.82 -143.42 9.14 Favored Glycine 0 C--N 1.301 -1.375 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -128.89 -80.45 0.27 Allowed Glycine 0 C--N 1.297 -1.619 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -64.99 -28.39 69.48 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -56.11 -43.06 77.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.076 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -70.47 -44.91 66.77 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.555 -178.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -55.96 -53.65 54.37 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 124.016 0.823 . . . . 0.0 110.342 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 mtm180 -62.4 -51.55 67.11 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.728 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 m -57.28 -48.34 79.14 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.075 0.234 . . . . 0.0 111.009 -178.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.28 -51.2 67.07 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.528 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.484 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 1.2 tm-20 -61.89 -38.26 87.69 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 124.399 1.079 . . . . 0.0 109.657 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 39.1 t -65.23 -50.72 64.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.126 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.51 -28.93 69.99 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -65.48 -36.44 83.89 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.241 0.616 . . . . 0.0 110.068 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.484 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.6 mtt180 -81.16 -55.2 4.91 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.195 0.998 . . . . 0.0 109.769 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.5 tp -73.75 -47.43 39.2 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.745 -1.57 . . . . 0.0 113.707 -168.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 64.07 86.25 0.13 Allowed 'General case' 0 C--O 1.241 0.624 0 CA-C-O 122.032 0.92 . . . . 0.0 110.192 -172.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 C--N 1.304 -1.406 0 CA-C-N 114.84 -1.073 . . . . 0.0 108.409 -178.239 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.747 0 CA-C-O 121.377 0.608 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 6' ' ' ILE . 65.8 mttm -79.61 -13.16 59.71 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -177.359 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -71.39 -39.54 71.1 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.4 m -68.5 -34.18 75.44 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 113.278 -1.783 . . . . 0.0 109.077 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.51 -44.22 96.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.575 176.231 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.47 HG13 ' O ' ' A' ' 2' ' ' LYS . 86.5 mt -61.65 -54.94 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -48.02 -48.02 33.12 Favored 'General case' 0 C--O 1.256 1.422 0 C-N-CA 124.398 1.079 . . . . 0.0 112.093 176.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . 0.402 ' HD3' ' C ' ' A' ' 8' ' ' ARG . 1.1 tmt_? -66.96 -44.87 79.41 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 119.561 -0.257 . . . . 0.0 110.425 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -62.11 -30.8 71.27 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.353 0.597 . . . . 0.0 110.61 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -63.15 -55.67 23.28 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.355 172.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 m -64.4 -29.98 71.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -56.39 -46.84 79.93 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.039 0.936 . . . . 0.0 110.172 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 63.6 t -85.61 -48.14 16.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.123 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' MET . . . . . 0.443 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 15.3 tpt -64.92 -28.09 69.29 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -173.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -112.88 98.4 45.06 Favored Pre-proline 0 C--N 1.312 -1.065 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . 0.443 ' HD3' ' O ' ' A' ' 14' ' ' MET . 60.6 Cg_endo -104.32 137.92 0.1 Allowed 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.417 2.744 . . . . 0.0 113.978 175.909 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 70.89 -17.53 0.3 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 171.126 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.439 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -90.4 105.42 3.25 Favored Glycine 0 C--N 1.304 -1.205 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.245 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.94 -34.1 87.71 Favored Glycine 0 N--CA 1.464 0.523 0 C-N-CA 121.576 -0.345 . . . . 0.0 113.121 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 4.6 mp0 -63.52 -44.4 94.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.04 -40.24 95.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.647 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.439 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 14.8 mm100 -56.73 -56.55 19.99 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.929 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -66.57 -39.35 88.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.056 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -58.1 -53.11 61.95 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 m -55.17 -41.98 72.57 Favored 'General case' 0 CA--C 1.509 -0.626 0 O-C-N 124.144 0.903 . . . . 0.0 112.868 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.21 -49.01 73.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.977 0.418 . . . . 0.0 109.941 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -64.58 -42.35 95.67 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.982 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -76.4 -27.25 56.25 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.579 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.3 t -73.12 -33.63 65.66 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.413 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 30.9 mm-40 -63.22 -46.08 88.63 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 171.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -58.38 -38.31 77.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.663 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -67.42 -40.74 85.53 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 123.713 0.805 . . . . 0.0 111.178 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 64.4 tp -74.16 -43.97 55.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.889 -178.746 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.413 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 96.9 mtt180 -69.66 119.12 13.41 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.167 -176.85 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 CA--C 1.496 -1.113 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.351 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.276 0 CA-C-O 121.203 0.525 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -71.23 -28.08 63.94 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.174 0.511 . . . . 0.0 110.149 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.478 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 45.6 mt-10 -71.19 -25.73 62.65 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.01 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -76.83 -41.6 43.61 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.63 -53.28 59.95 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.397 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.3 pt -68.79 -35.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.45 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 17.5 t -57.72 -42.19 83.28 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 122.818 0.447 . . . . 0.0 110.194 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -80.56 -50.73 9.62 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.005 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.99 -39.51 71.97 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.409 0.443 . . . . 0.0 112.037 -174.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -58.04 -51.59 69.05 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 123.35 0.406 . . . . 0.0 110.066 -177.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.4 m -73.14 -34.81 66.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -61.2 -39.52 90.52 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.303 0.573 . . . . 0.0 110.575 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -82.41 -30.47 9.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.394 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 27.6 ttt -64.72 -55.2 21.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.346 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.456 ' HZ1' ' CD ' ' A' ' 21' ' ' GLU . 13.9 mmmm -145.26 95.06 5.14 Favored Pre-proline 0 C--N 1.317 -0.845 0 C-N-CA 123.277 0.631 . . . . 0.0 109.558 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -74.39 123.09 7.94 Favored 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.526 2.151 . . . . 0.0 110.448 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 68.59 177.73 0.25 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.878 0.871 . . . . 0.0 111.872 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.25 -145.91 16.1 Favored Glycine 0 N--CA 1.432 -1.625 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -143.88 -73.89 0.03 OUTLIER Glycine 0 N--CA 1.437 -1.291 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.702 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.73 -43.41 93.49 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.07 0.462 . . . . 0.0 111.776 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.456 ' CD ' ' HZ1' ' A' ' 15' ' ' LYS . 40.2 mt-10 -65.46 -27.7 68.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.209 0.528 . . . . 0.0 110.206 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -71.03 -39.05 72.56 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.358 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -64.89 -45.23 86.81 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.565 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 19.9 tpp180 -54.99 -57.32 12.18 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 123.996 0.81 . . . . 0.0 110.851 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 18.6 m -62.78 -31.85 72.9 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.09 -47.6 67.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.21 176.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.47 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.565 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 47.5 mm-40 -61.98 -49.52 75.75 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.098 177.571 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.6 t -66.7 -55.26 15.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.245 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.75 -32.65 74.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -173.849 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.31 -17.53 39.26 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.009 -1.077 . . . . 0.0 112.525 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -81.26 -40.58 23.52 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 62.7 tp -75.25 -36.53 61.26 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.905 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 23.0 mmm180 76.3 -75.32 0.07 Allowed 'General case' 0 CA--C 1.504 -0.792 0 C-N-CA 124.927 1.291 . . . . 0.0 112.634 -178.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.3 t70 . . . . . 0 C--N 1.29 -2.017 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 -179.58 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.517 0 CA-C-O 121.151 0.5 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -72.66 -49.63 30.43 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.451 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.432 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -65.14 -27.86 69.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.171 -178.137 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.8 m -72.24 -48.08 45.49 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.399 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.93 -48.9 79.71 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.45 -40.05 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.089 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.432 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 26.2 t -55.03 -47.82 74.22 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.6 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -80.02 -39.25 30.31 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.501 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.421 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.7 tt0 -58.74 -37.62 76.6 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.5 0.72 . . . . 0.0 111.799 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -60.02 -52.23 66.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.88 -28.66 65.83 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.885 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.421 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 7.6 tt0 -57.89 -47.3 83.18 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 124.023 0.929 . . . . 0.0 110.079 177.136 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.0 m -87.05 -25.1 6.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.877 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 50.1 tpp -75.96 -49.24 18.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.479 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -134.85 80.57 48.83 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -178.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -71.87 118.66 5.75 Favored 'Trans proline' 0 C--O 1.248 0.987 0 C-N-CA 121.749 1.633 . . . . 0.0 111.249 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 59.68 20.43 9.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.943 0.897 . . . . 0.0 112.702 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -87.26 75.51 2.15 Favored Glycine 0 C--O 1.217 -0.925 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -30.11 -54.83 0.22 Allowed Glycine 0 N--CA 1.479 1.535 0 C-N-CA 126.212 1.863 . . . . 0.0 117.093 -173.47 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.78 -55.81 26.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 117.87 0.835 . . . . 0.0 111.399 -177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.68 -21.53 60.23 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.819 -177.32 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 30.1 tt0 -72.78 -41.73 64.69 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.616 176.233 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -70.93 -30.57 66.93 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 175.738 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.432 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 20.6 tpp180 -57.93 -50.24 74.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.695 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.6 m -58.67 -40.47 83.6 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.402 175.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 15.0 mm100 -59.37 -47.59 84.84 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.043 0.214 . . . . 0.0 110.472 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -60.34 -49.59 76.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.98 0.8 . . . . 0.0 110.276 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.432 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 44.2 mt-10 -64.33 -34.07 77.3 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.1 t -70.02 -41.48 74.24 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.409 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 46.6 mt-10 -63.21 -40.97 98.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -19.36 61.59 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.118 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -86.05 -50.42 7.05 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.088 0.471 . . . . 0.0 110.289 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.9 mt -71.49 -36.9 71.28 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.389 -175.679 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 70.0 mtt180 -90.65 146.29 24.15 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--N 1.287 -2.122 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 178.076 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.263 0 CA-C-O 121.003 0.43 . . . . 0.0 111.64 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -68.38 -26.12 65.41 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -175.608 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.55 -31.37 72.52 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.424 0.63 . . . . 0.0 110.237 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.3 m -79.08 -33.43 44.53 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.949 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -63.16 -51.6 65.78 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.33 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 69.2 mt -56.3 -46.31 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.2 t -54.2 -51.0 65.79 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 113.855 -1.521 . . . . 0.0 112.041 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -65.55 -43.0 91.24 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.528 -0.108 . . . . 0.0 110.773 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -61.25 -39.27 89.74 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -61.96 -54.39 42.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 123.575 0.547 . . . . 0.0 109.525 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 m -64.24 -29.91 70.98 Favored 'General case' 0 C--O 1.203 -1.395 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -66.06 -40.87 91.26 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 120.896 0.379 . . . . 0.0 110.765 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.8 p -89.06 -38.6 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 94.5 mmm -80.59 -25.33 38.55 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.17 96.13 49.82 Favored Pre-proline 0 C--N 1.309 -1.184 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -94.66 120.0 0.29 Allowed 'Trans proline' 0 N--CA 1.445 -1.377 0 C-N-CA 122.067 1.844 . . . . 0.0 111.989 176.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 68.28 -176.21 0.2 Allowed 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.908 0.883 . . . . 0.0 112.048 176.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.17 -41.68 2.16 Favored Glycine 0 C--N 1.297 -1.599 0 C-N-CA 121.208 -0.52 . . . . 0.0 111.805 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.63 -64.52 3.83 Favored Glycine 0 C--N 1.301 -1.405 0 C-N-CA 121.329 -0.462 . . . . 0.0 112.285 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.27 -40.24 81.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.053 0.541 . . . . 0.0 111.093 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.87 -36.17 82.42 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.649 0.738 . . . . 0.0 109.178 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -72.4 -41.2 66.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.698 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.524 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 29.0 tpt180 -56.34 -50.16 72.28 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.052 -0.977 . . . . 0.0 108.949 176.597 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -59.01 -42.24 89.65 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.304 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 m -54.3 -54.99 32.79 Favored 'General case' 0 C--O 1.215 -0.742 0 O-C-N 123.674 0.609 . . . . 0.0 112.021 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.78 -33.64 75.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.524 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 14.0 mm100 -62.12 -49.75 74.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -70.88 -29.62 65.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.518 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.2 t -63.79 -51.69 63.63 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.423 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.55 -25.31 62.16 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.66 -42.38 95.44 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -68.47 -37.93 80.59 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.925 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.55 -34.73 77.53 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.204 176.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 76.64 121.74 0.05 OUTLIER 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 125.578 1.551 . . . . 0.0 111.971 172.621 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 124.804 1.242 . . . . 0.0 109.664 -178.598 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.468 0 CA-C-O 120.785 0.326 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.461 ' O ' HG13 ' A' ' 6' ' ' ILE . 98.8 mttt -72.97 -42.18 63.6 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.32 -177.775 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -68.86 -32.74 72.62 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.9 m -64.88 -43.79 91.79 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.077 -1.42 . . . . 0.0 109.554 176.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.44 -43.76 93.29 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.274 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.4 mt -61.55 -50.39 80.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 t -51.52 -43.53 62.31 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.008 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -72.91 -46.48 52.4 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.222 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -59.14 -41.89 89.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -174.311 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 78.6 t90 -55.5 -48.38 74.7 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.609 0.568 . . . . 0.0 110.327 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -77.65 -30.02 51.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.733 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -67.45 -41.39 84.79 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.963 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.1 p -84.02 -20.68 8.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-O 121.176 0.513 . . . . 0.0 110.01 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 22.4 ttt -60.95 -54.49 44.32 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -153.62 101.12 2.55 Favored Pre-proline 0 N--CA 1.428 -1.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.977 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.29 119.64 6.89 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.96 1.773 . . . . 0.0 108.978 173.678 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 59.53 74.6 0.44 Allowed 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 111.398 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -105.54 164.14 14.04 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.8 -92.15 2.07 Favored Glycine 0 N--CA 1.425 -2.06 0 C-N-CA 120.87 -0.681 . . . . 0.0 111.992 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.56 -46.87 83.94 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.452 0.701 . . . . 0.0 111.75 -174.491 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -65.36 -38.32 89.71 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 120.789 0.328 . . . . 0.0 111.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.449 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 26.3 tt0 -70.45 -32.9 70.65 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -64.2 -42.19 96.74 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -57.68 -48.17 80.26 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.485 174.866 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.3 m -55.74 -40.69 72.86 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.72 178.031 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.506 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 78.1 mt-30 -57.34 -51.22 70.29 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 123.349 0.405 . . . . 0.0 109.991 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.54 -49.56 73.0 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.052 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.34 -47.94 83.87 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.06 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 7.7 t -63.02 -42.75 99.88 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 122.941 0.15 . . . . 0.0 110.985 -175.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.506 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 49.1 mt-10 -64.7 -39.96 94.55 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.953 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -87.15 -29.29 21.91 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.286 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -80.52 -44.46 19.07 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.104 0.478 . . . . 0.0 110.617 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 45.1 tp -81.65 -48.36 11.81 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.219 -179.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 73.1 mtp180 62.03 176.92 0.13 Allowed 'General case' 0 C--O 1.248 0.974 0 C-N-CA 124.159 0.984 . . . . 0.0 112.712 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.4 t70 . . . . . 0 C--N 1.299 -1.605 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 174.292 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.474 ' O ' ' HG2' ' A' ' 5' ' ' GLU . . . . . . . . 0 CA--C 1.514 -0.407 0 CA-C-O 120.776 0.322 . . . . 0.0 111.619 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -69.69 -39.17 77.1 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.582 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.25 -26.45 67.36 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.338 0.589 . . . . 0.0 110.699 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.1 m -70.48 -47.88 58.44 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.372 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 1' ' ' PCA . 16.0 mm-40 -62.67 -49.36 75.44 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.776 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.11 -53.33 44.64 Favored 'Isoleucine or valine' 0 C--O 1.245 0.833 0 CA-C-O 121.619 0.723 . . . . 0.0 109.662 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.25 -49.26 77.73 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.372 -1.285 . . . . 0.0 112.253 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -67.51 -41.56 84.25 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -56.57 -36.79 69.75 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 123.312 0.382 . . . . 0.0 110.614 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -59.66 -49.87 76.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.9 m -74.21 -27.34 60.74 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.924 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -69.62 -43.6 72.37 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.4 p -78.16 -20.46 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.338 0.589 . . . . 0.0 109.837 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 47.8 tpp -71.15 -49.38 44.55 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.688 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -151.88 107.88 2.86 Favored Pre-proline 0 N--CA 1.43 -1.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.311 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -57.58 139.78 91.3 Favored 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.704 2.269 . . . . 0.0 109.566 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 68.13 -67.21 0.2 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.683 1.193 . . . . 0.0 109.944 -172.059 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.432 ' HA3' ' HB2' ' A' ' 22' ' ' GLN . . . 87.71 -52.87 4.26 Favored Glycine 0 N--CA 1.436 -1.306 0 CA-C-N 116.578 -0.283 . . . . 0.0 112.919 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.39 -114.84 6.58 Favored Glycine 0 C--N 1.308 -1.009 0 N-CA-C 110.494 -1.043 . . . . 0.0 110.494 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -67.4 -29.04 68.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 117.153 0.477 . . . . 0.0 110.371 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.94 -31.37 66.27 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.158 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.432 ' HB2' ' HA3' ' A' ' 18' ' ' GLY . 4.4 tp-100 -76.17 -36.86 58.5 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.551 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 68.7 mtt180 -65.61 -39.36 91.45 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.298 176.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -64.42 -43.76 93.35 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.1 m -60.32 -39.52 87.34 Favored 'General case' 0 C--O 1.2 -1.503 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.403 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -58.22 -46.2 86.31 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.296 0.638 . . . . 0.0 109.973 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.551 ' HG3' ' O ' ' A' ' 23' ' ' ARG . 18.8 mt-30 -55.73 -52.87 62.42 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.802 0.689 . . . . 0.0 109.612 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -65.89 -39.6 90.79 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.357 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 t -65.42 -43.46 90.42 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 122.905 0.482 . . . . 0.0 110.263 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -62.85 -47.1 84.82 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.832 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.49 -38.32 86.87 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.456 0.702 . . . . 0.0 110.979 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -63.47 -45.42 90.89 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 123.813 0.845 . . . . 0.0 110.317 175.642 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.1 tp -69.65 -47.94 61.58 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.439 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -167.72 131.39 1.71 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.2 t70 . . . . . 0 C--N 1.3 -1.586 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.708 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.42 0 CA-C-O 121.082 0.467 . . . . 0.0 111.739 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.441 ' HB2' ' HZ3' ' A' ' 2' ' ' LYS . 10.1 mtmp? -72.36 -38.57 68.53 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.747 0.784 . . . . 0.0 108.946 178.131 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . 0.513 ' H ' ' CD ' ' A' ' 3' ' ' GLU . 2.1 mp0 -54.25 -52.38 61.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 125.864 1.666 . . . . 0.0 109.574 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 p -72.85 -34.92 67.09 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 113.197 -1.819 . . . . 0.0 111.824 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.14 -52.27 66.44 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 122.593 0.357 . . . . 0.0 110.464 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 78.0 mt -60.88 -50.78 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.5 t -52.98 -47.0 68.51 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 114.131 -1.395 . . . . 0.0 111.18 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -61.92 -48.29 81.08 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 123.863 0.865 . . . . 0.0 110.529 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -61.72 -37.5 84.42 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.925 0.765 . . . . 0.0 111.686 -175.106 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -56.71 -53.04 62.31 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 121.477 0.656 . . . . 0.0 109.738 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.7 m -66.66 -37.61 85.14 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -64.79 -44.3 90.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.394 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.5 p -73.16 -29.86 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.156 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 17.2 tpt -69.42 -54.66 13.25 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.511 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -148.87 108.11 3.47 Favored Pre-proline 0 C--N 1.321 -0.672 0 C-N-CA 123.751 0.82 . . . . 0.0 109.604 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -66.5 119.45 6.48 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 121.82 1.68 . . . . 0.0 111.668 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 51.11 -95.43 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 126.177 1.791 . . . . 0.0 114.272 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.48 -115.24 5.55 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -161.88 -80.61 0.04 OUTLIER Glycine 0 N--CA 1.415 -2.712 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.0 -31.86 73.3 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -70.75 -41.07 72.28 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.66 -37.92 65.13 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.481 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.463 ' HD3' ' OE1' ' A' ' 26' ' ' GLN . 39.9 mmt180 -63.93 -41.04 97.74 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.078 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.424 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 51.0 ttp180 -63.68 -46.7 84.36 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.075 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 43.9 m -57.89 -34.48 69.84 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.463 ' OE1' ' HD3' ' A' ' 23' ' ' ARG . 54.6 mt-30 -60.64 -49.63 76.74 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.364 0.529 . . . . 0.0 110.355 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -62.41 -46.79 86.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.474 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.581 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 23.2 mm-40 -63.3 -46.91 84.53 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.191 0.596 . . . . 0.0 111.689 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 10.5 t -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 122.774 0.43 . . . . 0.0 111.0 -175.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.15 -25.09 61.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.604 -0.439 . . . . 0.0 110.656 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.31 -39.58 85.91 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 174.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.581 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 13.1 mmt180 -67.6 -38.08 83.49 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.55 176.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.9 tp -70.49 -25.45 63.16 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.729 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -82.98 -8.18 59.59 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.598 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.4 t70 . . . . . 0 C--N 1.307 -1.267 0 CA-C-O 118.797 -0.62 . . . . 0.0 110.51 -178.978 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.403 ' O ' ' HB ' ' A' ' 4' ' ' THR . . . . . . . . 0 N--CA 1.465 0.288 0 CA-C-O 121.299 0.571 . . . . 0.0 110.855 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -63.64 -53.42 51.77 Favored 'General case' 0 C--O 1.252 1.2 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.448 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -79.05 -13.61 59.66 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.768 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.403 ' HB ' ' O ' ' A' ' 1' ' ' PCA . 80.7 m -65.54 -45.17 84.42 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 173.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -59.25 -47.27 85.99 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.203 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.2 -54.88 26.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.072 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.3 t -54.98 -48.74 72.89 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.418 -1.264 . . . . 0.0 111.796 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -66.95 -46.96 73.12 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.118 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.401 ' O ' HG23 ' A' ' 13' ' ' VAL . 6.8 tp60 -57.46 -38.52 74.61 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.594 0.559 . . . . 0.0 110.584 -177.172 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -54.94 -54.93 36.44 Favored 'General case' 0 C--O 1.249 1.057 0 C-N-CA 123.666 0.786 . . . . 0.0 110.746 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.4 m -70.8 -36.22 72.9 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.075 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -61.33 -39.33 90.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.814 0.846 . . . . 0.0 111.547 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.401 HG23 ' O ' ' A' ' 9' ' ' GLN . 34.1 m -83.14 -30.87 8.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 61.0 mtm -77.83 -54.09 6.74 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 119.368 -0.933 . . . . 0.0 111.9 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -156.7 91.37 2.52 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.0 128.74 8.54 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.26 1.973 . . . . 0.0 113.036 -177.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 69.22 127.14 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.924 1.29 . . . . 0.0 113.678 175.531 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -177.56 164.17 33.11 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 109.234 -1.547 . . . . 0.0 109.234 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.33 -86.87 0.28 Allowed Glycine 0 N--CA 1.438 -1.222 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.351 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.532 ' OE2' ' HD3' ' A' ' 23' ' ' ARG . 5.9 tp10 -70.35 -33.12 71.09 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -178.708 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.11 -60.21 4.09 Favored 'General case' 0 C--O 1.245 0.859 0 C-N-CA 123.895 0.878 . . . . 0.0 110.922 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 56.2 tp60 -72.39 -23.83 61.16 Favored 'General case' 0 C--O 1.2 -1.549 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.019 -177.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.532 ' HD3' ' OE2' ' A' ' 20' ' ' GLU . 33.6 ttt180 -62.8 -33.96 76.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -63.09 -48.7 77.48 Favored 'General case' 0 CA--C 1.502 -0.878 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 175.433 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.9 m -58.75 -38.45 78.44 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.211 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 14.2 mm100 -61.38 -48.86 79.34 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 177.948 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.473 ' O ' ' HB2' ' A' ' 31' ' ' GLU . 24.8 mt-30 -63.4 -43.77 96.58 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.9 0.381 . . . . 0.0 111.586 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.662 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 6.8 mm-40 -67.48 -53.32 29.76 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.156 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.5 t -67.3 -51.95 46.37 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.192 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.82 -26.76 64.4 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -174.864 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.473 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -79.42 -27.51 41.76 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.016 176.699 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.662 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 34.3 mtm180 -81.44 -38.89 25.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.263 0.554 . . . . 0.0 110.206 178.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.4 mt -81.36 -28.03 34.63 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.857 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.6 ttp180 66.62 -87.49 0.03 OUTLIER 'General case' 0 C--O 1.244 0.798 0 C-N-CA 125.352 1.461 . . . . 0.0 110.019 -176.111 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 C--N 1.313 -1.0 0 C-N-CA 125.716 1.606 . . . . 0.0 107.395 -175.881 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.216 0 CA-C-O 120.653 0.263 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.428 ' O ' HG13 ' A' ' 6' ' ' ILE . 66.3 mttm -60.29 -50.34 74.04 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.517 -176.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.95 -41.12 82.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.447 0.641 . . . . 0.0 109.415 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.2 m -58.76 -42.83 89.8 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.253 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.38 -45.25 91.94 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.496 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.428 HG13 ' O ' ' A' ' 2' ' ' LYS . 58.6 mt -63.99 -50.48 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.908 0.861 . . . . 0.0 108.741 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.0 t -52.8 -45.91 67.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.864 -1.516 . . . . 0.0 112.414 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -30.81 51.65 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.526 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.507 ' O ' HG21 ' A' ' 13' ' ' VAL . 23.2 tp60 -60.2 -42.85 95.97 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 90.8 t90 -55.72 -43.84 76.91 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 123.649 0.78 . . . . 0.0 109.849 177.092 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.4 m -68.97 -36.71 78.2 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.65 -28.73 70.11 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 120.964 0.411 . . . . 0.0 111.334 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.507 HG21 ' O ' ' A' ' 9' ' ' GLN . 88.0 t -75.24 -38.97 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 121.446 0.641 . . . . 0.0 109.347 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.3 ttt -68.62 -54.66 15.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.737 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -156.46 101.59 2.04 Favored Pre-proline 0 C--N 1.307 -1.28 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -57.91 118.72 5.65 Favored 'Trans proline' 0 C--O 1.252 1.195 0 C-N-CA 122.406 2.071 . . . . 0.0 111.202 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 53.88 51.85 14.05 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.259 0.974 . . . . 0.0 110.405 -177.213 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.96 164.58 51.6 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.898 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.36 -95.92 0.3 Allowed Glycine 0 N--CA 1.432 -1.627 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -69.45 -26.21 64.48 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.648 -178.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -59.22 -56.88 16.54 Favored 'General case' 0 C--O 1.217 -0.606 0 O-C-N 123.546 0.529 . . . . 0.0 110.656 176.501 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -67.24 -29.73 69.44 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -176.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 25.5 mmm180 -63.98 -56.61 13.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.352 174.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -59.73 -40.79 89.23 Favored 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 123.414 0.447 . . . . 0.0 109.812 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.621 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 21.9 m -49.81 -56.95 8.44 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 124.243 0.964 . . . . 0.0 111.052 173.424 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -65.78 -33.93 77.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . 0.413 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 15.6 mm100 -57.96 -51.01 71.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.261 0.351 . . . . 0.0 111.174 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.35 -29.45 42.23 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.979 0.418 . . . . 0.0 111.163 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.621 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.6 t -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.417 0.687 . . . . 0.0 109.21 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -74.07 -28.06 61.2 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.434 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 14.8 tp10 -61.4 -46.24 91.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.019 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -74.39 -33.3 63.0 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.515 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.6 tp -67.08 -47.85 69.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.441 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 49.0 ttt-85 -79.97 105.5 11.3 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.2 t70 . . . . . 0 C--N 1.299 -1.628 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.1 -174.607 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.463 0 CA-C-O 120.923 0.392 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -64.92 -45.77 84.47 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.656 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.98 -31.61 69.39 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.37 -178.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -64.47 -49.0 73.14 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.819 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.582 ' O ' ' HG3' ' A' ' 9' ' ' GLN . 8.3 tp10 -60.89 -48.97 79.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.215 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 82.6 mt -55.72 -52.91 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 CA-C-O 121.29 0.567 . . . . 0.0 109.667 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.9 t -52.39 -47.05 66.44 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.665 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -68.72 -35.72 77.51 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.614 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.582 ' HG3' ' O ' ' A' ' 5' ' ' GLU . 57.4 mt-30 -57.9 -37.67 74.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 118.158 0.435 . . . . 0.0 111.111 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.51 -50.62 73.09 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.057 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 m -82.04 -13.2 57.69 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -67.9 -34.18 76.14 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.7 t -79.6 -39.72 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.252 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.3 mmt -68.35 -55.23 12.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -136.6 87.04 21.59 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-O 120.871 0.367 . . . . 0.0 111.144 -176.219 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -88.49 120.15 1.2 Allowed 'Trans proline' 0 N--CA 1.443 -1.489 0 C-N-CA 122.643 2.229 . . . . 0.0 110.476 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 64.55 90.59 0.08 Allowed 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.872 1.269 . . . . 0.0 111.546 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.91 -173.17 20.68 Favored Glycine 0 N--CA 1.434 -1.447 0 C-N-CA 120.186 -1.006 . . . . 0.0 112.216 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.0 -96.25 2.24 Favored Glycine 0 N--CA 1.429 -1.801 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -63.34 -41.44 98.87 Favored 'General case' 0 C--O 1.207 -1.162 0 C-N-CA 122.979 0.512 . . . . 0.0 111.126 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -66.64 -32.56 73.95 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.265 0.555 . . . . 0.0 111.161 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -76.21 -37.93 57.13 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -64.58 -38.98 92.88 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.876 175.68 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -54.99 -52.22 63.77 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.573 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 m -64.97 -33.51 76.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.037 177.305 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.28 -48.85 63.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -61.03 -45.3 95.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.156 0.582 . . . . 0.0 109.607 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -53.23 -47.2 69.2 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.809 173.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.2 t -70.57 -41.01 72.98 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.277 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.466 ' HB3' ' NH1' ' A' ' 34' ' ' ARG . 48.5 mt-10 -60.7 -45.04 95.7 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.954 0.407 . . . . 0.0 110.52 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -68.57 -22.45 64.47 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.643 0.735 . . . . 0.0 110.941 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -87.88 -34.76 18.07 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.546 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.8 tp -76.44 -48.22 20.4 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.679 179.053 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . 0.466 ' NH1' ' HB3' ' A' ' 30' ' ' GLU . 61.1 mtt180 -73.95 -45.94 47.16 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.598 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 C--N 1.311 -1.068 0 O-C-N 124.97 1.419 . . . . 0.0 111.385 -179.807 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.592 0 CA-C-O 120.972 0.415 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -61.03 -37.75 83.71 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 124.069 0.948 . . . . 0.0 111.957 -176.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -61.24 -46.84 88.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.81 0.814 . . . . 0.0 110.398 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.0 m -74.51 -23.27 58.81 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.585 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.4 -51.01 61.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.772 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.27 -32.64 56.61 Favored 'Isoleucine or valine' 0 C--O 1.251 1.175 0 CA-C-O 121.492 0.663 . . . . 0.0 109.329 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.12 -48.17 82.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.797 175.218 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.2 ttt180 -64.86 -40.99 96.01 Favored 'General case' 0 C--O 1.213 -0.858 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -50.33 -37.38 36.42 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.524 1.13 . . . . 0.0 111.706 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.7 t90 -57.93 -49.18 77.63 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 121.744 0.783 . . . . 0.0 109.766 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.5 m -78.77 -31.06 45.96 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.195 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -63.6 -43.9 95.56 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 123.786 0.835 . . . . 0.0 109.932 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 p -78.14 -29.74 15.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.409 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.9 ttp -60.93 -55.1 36.99 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -157.12 108.05 1.9 Allowed Pre-proline 0 N--CA 1.439 -0.999 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.5 119.85 7.05 Favored 'Trans proline' 0 C--O 1.25 1.116 0 C-N-CA 122.121 1.881 . . . . 0.0 111.471 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 69.46 173.35 0.3 Allowed 'General case' 0 C--O 1.252 1.208 0 C-N-CA 124.51 1.124 . . . . 0.0 112.507 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 155.36 166.67 15.86 Favored Glycine 0 N--CA 1.421 -2.312 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 177.583 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.94 -87.79 1.06 Allowed Glycine 0 C--N 1.295 -1.731 0 C-N-CA 119.872 -1.156 . . . . 0.0 110.692 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.495 ' O ' ' HG3' ' A' ' 24' ' ' ARG . 39.0 mt-10 -67.96 -37.17 81.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.929 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.8 mp0 -54.95 -42.18 72.0 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 123.648 0.592 . . . . 0.0 110.394 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -71.55 -38.62 70.98 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.727 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -68.09 -33.94 75.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.161 0.505 . . . . 0.0 109.966 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.495 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 91.8 mtt180 -65.48 -54.48 27.7 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.595 177.04 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.02 -37.27 74.01 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -59.01 -51.55 69.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 177.062 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -63.4 -46.73 85.06 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.52 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 32.7 mm-40 -55.22 -47.52 75.2 Favored 'General case' 0 C--O 1.217 -0.612 0 O-C-N 123.59 0.556 . . . . 0.0 110.645 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.7 t -59.45 -44.18 93.0 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.584 -178.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.12 -40.14 86.78 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.89 -30.58 61.34 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.52 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.5 mtt180 -73.2 -43.62 61.04 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.1 tp -64.39 -48.18 76.39 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.081 176.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 51.62 77.63 0.14 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.116 1.366 . . . . 0.0 111.489 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 C--N 1.288 -2.099 0 CA-C-N 113.494 -1.685 . . . . 0.0 107.929 -178.937 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.172 0 CA-C-O 120.784 0.326 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -65.02 -29.45 70.36 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -177.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -69.16 -30.08 68.24 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 121.641 0.734 . . . . 0.0 110.015 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . 0.417 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 26.4 m -78.35 -32.95 49.32 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.234 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.501 ' HG2' ' NE2' ' A' ' 9' ' ' GLN . 36.2 tt0 -63.1 -52.24 63.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.799 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.8 pt -66.17 -33.87 66.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.237 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.417 ' HB3' ' O ' ' A' ' 4' ' ' THR . 38.1 t -52.45 -47.58 66.35 Favored 'General case' 0 C--O 1.245 0.823 0 O-C-N 123.88 0.738 . . . . 0.0 111.041 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -78.39 -41.85 32.0 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.369 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.501 ' NE2' ' HG2' ' A' ' 5' ' ' GLU . 49.6 mt-30 -56.96 -41.25 78.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.219 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -59.02 -51.6 69.38 Favored 'General case' 0 N--CA 1.443 -0.779 0 O-C-N 123.757 0.661 . . . . 0.0 109.263 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.9 m -64.31 -39.58 94.19 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.369 178.62 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.46 -45.4 93.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.057 0.456 . . . . 0.0 111.217 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 88.0 t -77.0 -45.86 30.0 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.401 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 16.3 tpt -70.02 -49.49 50.81 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.869 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.429 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 16.5 ptpt -130.56 79.7 71.63 Favored Pre-proline 0 C--N 1.308 -1.216 0 CA-C-O 121.734 0.778 . . . . 0.0 112.015 -175.111 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -82.94 120.66 3.06 Favored 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 122.87 2.38 . . . . 0.0 111.732 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 69.23 99.95 0.06 Allowed 'General case' 0 C--O 1.241 0.623 0 C-N-CA 124.989 1.316 . . . . 0.0 111.735 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -158.82 167.77 34.82 Favored Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 178.659 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.02 -90.95 1.63 Allowed Glycine 0 N--CA 1.431 -1.692 0 C-N-CA 120.382 -0.914 . . . . 0.0 111.384 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -64.42 -31.45 72.67 Favored 'General case' 0 C--O 1.214 -0.799 0 C-N-CA 122.33 0.252 . . . . 0.0 111.667 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.429 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 67.5 mm-40 -60.88 -50.81 71.93 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 120.809 0.338 . . . . 0.0 111.573 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -75.18 -32.86 61.37 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.967 0.413 . . . . 0.0 109.933 -178.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.03 -42.03 98.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.318 0.58 . . . . 0.0 109.595 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -63.35 -44.12 95.74 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.826 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 28.7 m -55.95 -47.12 78.18 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.454 0.471 . . . . 0.0 110.781 174.513 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -55.21 -56.67 17.32 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.52 0.513 . . . . 0.0 111.082 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -60.81 -46.72 89.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.356 -176.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -63.14 -41.44 99.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.208 0.527 . . . . 0.0 110.445 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.465 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.4 t -65.68 -45.35 83.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.09 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.66 -27.97 62.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.207 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -71.67 -36.39 70.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -70.28 -38.02 74.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.7 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.2 tp -58.13 -40.12 80.47 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.692 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 59.66 71.68 0.57 Allowed 'General case' 0 C--O 1.242 0.662 0 O-C-N 124.141 0.901 . . . . 0.0 110.75 179.011 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.1 t70 . . . . . 0 C--N 1.299 -1.59 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.609 -176.187 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.949 0 CA-C-O 120.933 0.397 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -62.24 -40.31 95.75 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -176.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.65 -30.62 70.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.345 0.593 . . . . 0.0 110.059 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.4 m -69.78 -36.55 75.83 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.561 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.59 -50.49 67.01 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.835 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.34 -50.42 80.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.932 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.9 t -50.47 -44.47 55.72 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.201 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -74.62 -48.82 24.25 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.975 177.731 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -54.7 -39.5 68.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.321 0.648 . . . . 0.0 111.99 -176.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 77.9 t90 -55.07 -52.97 61.52 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 123.78 0.675 . . . . 0.0 110.182 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -75.94 -32.21 59.45 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -56.63 -46.71 80.81 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.623 0.769 . . . . 0.0 110.602 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -86.01 -38.9 13.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.403 -177.125 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 15.1 tpt -62.23 -40.4 96.02 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.804 0.335 . . . . 0.0 111.624 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -127.3 108.84 21.31 Favored Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.075 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -54.91 158.59 10.85 Favored 'Trans proline' 0 C--O 1.25 1.101 0 C-N-CA 122.938 2.425 . . . . 0.0 111.261 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -63.81 112.51 2.92 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.505 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -128.67 -91.96 0.69 Allowed Glycine 0 N--CA 1.426 -1.968 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.03 -80.47 0.04 OUTLIER Glycine 0 C--N 1.302 -1.346 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.936 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . 0.403 ' O ' ' HG3' ' A' ' 24' ' ' ARG . 3.7 mp0 -57.52 -39.65 77.02 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 123.061 0.545 . . . . 0.0 110.769 -176.997 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 1.3 mp0 -50.42 -54.95 18.13 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 124.632 1.173 . . . . 0.0 110.304 178.324 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -67.83 -37.98 82.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.531 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -61.24 -47.49 85.83 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.403 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 75.2 mtp180 -63.34 -46.67 85.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.004 178.342 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.2 m -62.25 -31.81 72.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -66.67 -43.75 83.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -64.59 -48.71 73.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.087 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.434 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 60.3 mm-40 -59.46 -43.72 93.13 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.958 177.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -59.6 -57.82 11.26 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.492 0.495 . . . . 0.0 110.74 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -57.7 -39.93 78.32 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.57 -43.31 97.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.647 -178.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.434 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 51.0 mtt180 -89.42 -28.69 19.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.656 -175.762 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.2 tp -71.7 -36.73 70.66 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.168 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -91.98 82.35 5.12 Favored 'General case' 0 N--CA 1.429 -1.524 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 C--N 1.292 -1.897 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.325 -177.965 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . 0.475 ' O ' ' HG2' ' A' ' 5' ' ' GLU . . . . . . . . 0 CA--C 1.507 -0.681 0 CA-C-O 121.249 0.547 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -60.96 -45.78 93.35 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.111 -0.949 . . . . 0.0 111.261 -176.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.52 -31.45 72.18 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.975 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.0 m -72.07 -36.46 69.56 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 1' ' ' PCA . 16.8 mm-40 -67.69 -52.93 32.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.645 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.54 -38.07 81.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.3 t -58.74 -42.94 89.97 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.877 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.6 tpt180 -75.71 -45.24 37.82 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.909 178.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.74 -31.83 72.84 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -59.85 -49.17 78.75 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 70.2 m -66.67 -43.57 84.14 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.762 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -59.29 -42.41 91.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.968 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.7 m -86.11 -19.64 8.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.35 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.2 ttt -75.08 -47.94 26.34 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.307 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -156.37 99.07 2.12 Favored Pre-proline 0 N--CA 1.438 -1.059 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.123 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -85.66 120.08 2.01 Favored 'Trans proline' 0 N--CA 1.451 -1.02 0 C-N-CA 122.609 2.206 . . . . 0.0 110.549 176.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -164.59 -51.6 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.31 0.576 . . . . 0.0 110.635 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.407 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 105.49 -137.06 13.54 Favored Glycine 0 N--CA 1.416 -2.658 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 -174.859 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.541 ' O ' ' HG2' ' A' ' 23' ' ' ARG . . . 55.58 -135.99 47.65 Favored Glycine 0 C--O 1.246 0.898 0 O-C-N 123.934 0.432 . . . . 0.0 113.71 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.37 -30.11 63.07 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 122.693 0.397 . . . . 0.0 110.591 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -58.92 -43.85 91.19 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.954 0.883 . . . . 0.0 108.717 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.407 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 9.6 tt0 -69.96 -39.02 76.26 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.45 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.541 ' HG2' ' O ' ' A' ' 19' ' ' GLY . 30.9 mmm180 -61.8 -44.18 97.37 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.455 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 34.9 mmt180 -61.65 -49.67 75.6 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.529 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 24.6 m -62.13 -37.31 84.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 177.202 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -57.67 -52.98 63.2 Favored 'General case' 0 C--O 1.245 0.821 0 C-N-CA 122.935 0.494 . . . . 0.0 110.5 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -55.56 -58.86 6.05 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.486 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.455 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.8 pt-20 -66.68 -33.69 76.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.273 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 10.1 t -65.54 -52.53 51.74 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.365 0.126 . . . . 0.0 110.704 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -72.39 -25.93 61.69 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.38 -42.68 64.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -67.94 -37.76 82.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.119 177.744 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.5 tp -69.91 -33.65 72.46 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.766 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -69.35 106.39 2.9 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.36 0.6 . . . . 0.0 110.055 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 C--N 1.286 -2.189 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 179.175 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.198 0 CA-C-O 121.494 0.664 . . . . 0.0 110.452 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -68.59 -36.48 78.77 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.426 -175.792 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.73 -27.35 61.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 121.598 0.713 . . . . 0.0 110.974 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 m -74.7 -33.49 62.44 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.796 178.142 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -62.63 -47.74 82.4 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.04 176.949 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.7 -47.85 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.572 176.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.5 t -46.98 -46.58 21.73 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.944 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -70.22 -45.67 66.07 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.38 176.082 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -56.0 -35.15 66.48 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.288 0.367 . . . . 0.0 111.818 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -60.97 -55.41 33.29 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.071 0.462 . . . . 0.0 110.035 176.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.25 -32.56 72.84 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.518 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -57.28 -48.82 77.91 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 123.554 0.742 . . . . 0.0 110.631 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.7 t -79.53 -39.63 20.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.321 -0.854 . . . . 0.0 112.268 -176.498 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 60.0 mtt -84.0 -27.51 28.36 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -175.871 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.467 ' CG ' ' HB3' ' A' ' 21' ' ' GLU . 4.7 mptp? -108.91 107.35 59.96 Favored Pre-proline 0 C--N 1.308 -1.231 0 O-C-N 122.249 -0.282 . . . . 0.0 110.296 -177.241 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.56 121.19 8.68 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 123.507 2.805 . . . . 0.0 113.335 -178.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 68.3 -66.72 0.22 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.004 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 155.2 -120.95 1.05 Allowed Glycine 0 N--CA 1.424 -2.128 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.783 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.6 -143.98 26.25 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -56.2 -32.5 64.44 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.019 0.438 . . . . 0.0 111.214 177.642 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.467 ' HB3' ' CG ' ' A' ' 15' ' ' LYS . 33.1 mm-40 -61.61 -40.69 95.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.672 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -76.78 -34.45 58.0 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.594 -178.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.71 -50.64 71.62 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.249 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.8 ttt180 -59.9 -45.76 91.49 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.158 177.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 31.5 m -59.27 -39.8 84.06 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.469 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 50.1 tt0 -62.29 -49.17 76.71 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.781 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.02 -52.48 63.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.766 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -68.21 -29.03 67.77 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.462 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.3 t -71.94 -43.56 65.05 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.469 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 58.8 mt-10 -68.79 -32.65 72.53 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.083 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.66 -38.34 83.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.657 0.741 . . . . 0.0 109.528 177.603 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -79.04 -34.05 44.18 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.961 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.9 tp -74.12 -32.01 63.01 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.286 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.6 ttp180 69.05 -77.08 0.05 Allowed 'General case' 0 C--O 1.237 0.44 0 C-N-CA 125.714 1.606 . . . . 0.0 111.313 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.1 t70 . . . . . 0 CA--C 1.488 -1.408 0 C-N-CA 125.346 1.459 . . . . 0.0 107.902 -174.501 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.468 0 CA-C-O 121.47 0.652 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.512 ' O ' HG13 ' A' ' 6' ' ' ILE . 67.0 mttm -69.38 -16.61 63.55 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -175.375 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.57 -40.2 80.66 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-O 121.635 0.731 . . . . 0.0 109.628 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 m -75.07 -32.6 61.54 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-N 114.383 -1.281 . . . . 0.0 108.886 178.493 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -58.94 -52.1 67.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.103 177.14 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.512 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.6 mt -57.93 -48.14 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.4 t -49.44 -53.8 20.97 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-N 114.148 -1.387 . . . . 0.0 111.916 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.05 -37.98 69.58 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.453 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -56.12 -41.21 74.92 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.866 0.466 . . . . 0.0 110.302 -179.261 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -60.76 -46.61 89.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.793 178.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.7 m -71.26 -30.61 66.51 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -64.91 -32.34 74.0 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.672 0.748 . . . . 0.0 109.929 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.4 t -85.71 -46.65 16.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.762 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.4 mmt -74.42 -39.29 62.71 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -176.567 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.438 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 64.7 mttm -131.3 74.61 78.78 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 122.872 0.469 . . . . 0.0 109.905 -177.437 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -87.58 120.18 1.44 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.688 2.259 . . . . 0.0 112.514 -176.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 63.82 -176.6 0.16 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.454 1.102 . . . . 0.0 111.655 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.65 -97.41 0.93 Allowed Glycine 0 C--N 1.29 -1.986 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . 0.49 ' O ' ' HG3' ' A' ' 23' ' ' ARG . . . 176.5 -91.6 0.08 OUTLIER Glycine 0 N--CA 1.426 -1.998 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.298 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.88 -45.09 70.96 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 -173.164 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.438 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 28.4 mm-40 -67.72 -35.57 79.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.048 0.451 . . . . 0.0 111.415 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.62 -38.93 70.74 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.158 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.49 ' HG3' ' O ' ' A' ' 19' ' ' GLY . 73.7 mtp180 -61.26 -42.79 99.23 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.966 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -61.83 -42.55 99.17 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.288 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.43 ' SG ' ' HD2' ' A' ' 15' ' ' LYS . 1.8 m -64.74 -34.92 79.45 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.425 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 34.8 tt0 -63.31 -50.6 69.4 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.398 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.12 -49.31 78.15 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.975 178.384 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -53.01 -49.44 66.22 Favored 'General case' 0 CA--C 1.498 -1.034 0 C-N-CA 123.891 0.876 . . . . 0.0 112.881 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 5.9 t -68.0 -34.48 76.6 Favored 'General case' 0 C--N 1.308 -1.225 0 O-C-N 123.55 0.531 . . . . 0.0 110.607 -175.676 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.425 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 12.2 mm-40 -68.85 -38.96 80.14 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.792 178.862 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -76.13 -18.76 59.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.989 0.423 . . . . 0.0 110.991 178.371 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -85.55 -54.58 4.47 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.199 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -85.67 -33.85 21.46 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.706 -178.26 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 60.42 93.73 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 176.145 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.8 t70 . . . . . 0 C--N 1.291 -1.946 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 176.02 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.373 0 CA-C-O 121.562 0.696 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . 0.46 ' O ' ' HB3' ' A' ' 5' ' ' GLU . 74.0 mmtt -80.86 -32.27 35.08 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.901 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -78.48 -26.62 46.08 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.124 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.6 m -72.27 -32.34 66.55 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.397 175.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.46 ' HB3' ' O ' ' A' ' 2' ' ' LYS . 13.3 tp10 -62.06 -52.15 65.08 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.875 175.743 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . 0.454 HG13 ' O ' ' A' ' 2' ' ' LYS . 61.2 mt -58.01 -50.41 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 121.396 0.617 . . . . 0.0 109.553 178.388 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.0 t -54.12 -48.17 71.04 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.346 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -69.92 -39.24 76.26 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.099 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -58.38 -38.62 77.67 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 178.018 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . 0.418 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 82.9 t90 -59.18 -55.06 39.76 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.418 ' SG ' ' HE3' ' A' ' 10' ' ' TRP . 96.4 m -67.41 -34.07 76.48 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.771 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -58.8 -45.88 88.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.031 0.443 . . . . 0.0 110.597 178.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.8 p -82.17 -35.16 12.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.178 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.52 -47.94 57.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.008 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -126.79 96.09 35.96 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.353 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -64.51 141.17 72.53 Favored 'Trans proline' 0 C--O 1.244 0.792 0 C-N-CA 122.157 1.905 . . . . 0.0 110.061 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 75.67 -53.44 0.63 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.417 1.487 . . . . 0.0 110.758 -176.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.6 -78.79 0.33 Allowed Glycine 0 N--CA 1.43 -1.766 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.213 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.05 -119.22 12.71 Favored Glycine 0 C--N 1.307 -1.083 0 N-CA-C 112.058 -0.417 . . . . 0.0 112.058 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -66.85 -34.13 77.12 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.79 0.805 . . . . 0.0 109.036 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.66 -18.53 60.52 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.646 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 18.7 tm0? -67.4 -45.53 75.88 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 17.6 mmm180 -59.81 -48.98 79.51 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 124.152 0.908 . . . . 0.0 109.584 178.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . 0.542 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 71.7 ttt180 -57.66 -56.87 16.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.482 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.503 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 10.7 m -57.36 -44.58 84.48 Favored 'General case' 0 C--O 1.204 -1.293 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 36.0 tt0 -63.47 -40.66 97.71 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -64.65 -44.65 89.77 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.564 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . 0.542 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.0 mm-40 -71.77 -29.52 64.57 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.071 0.462 . . . . 0.0 110.066 179.316 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.503 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.2 t -69.6 -47.6 62.96 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.079 -177.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 10.0 pt-20 -67.26 -27.3 67.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.988 0.423 . . . . 0.0 110.618 177.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.23 -46.04 71.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.477 174.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -64.95 -33.88 77.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.903 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -70.88 -29.24 65.28 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.203 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -72.7 -57.2 4.29 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.392 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 . . . . . 0 C--N 1.299 -1.628 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.567 -179.435 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.476 0 CA-C-O 121.085 0.469 . . . . 0.0 111.63 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -67.63 -34.66 77.41 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.164 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -70.13 -26.91 64.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.433 0.635 . . . . 0.0 111.036 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.7 m -74.97 -30.67 61.26 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.907 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -65.98 -42.44 89.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.547 176.06 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.8 mt -62.42 -46.35 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -54.52 -44.37 72.7 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.454 -1.248 . . . . 0.0 110.695 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -68.91 -41.57 78.04 Favored 'General case' 0 C--O 1.216 -0.7 0 O-C-N 122.175 -0.328 . . . . 0.0 110.412 175.732 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . 0.449 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.3 tt0 -57.11 -40.64 77.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 123.556 0.742 . . . . 0.0 111.807 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -60.44 -50.43 73.63 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 123.473 0.483 . . . . 0.0 110.195 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.75 -30.34 67.91 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.2 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . 0.449 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 8.3 tt0 -55.74 -46.59 77.76 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.002 0.921 . . . . 0.0 110.146 177.809 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.0 t -83.29 -29.66 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.189 -178.373 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.0 ttt -61.72 -53.06 61.2 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.053 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 17.4 tppt? -148.3 94.28 4.25 Favored Pre-proline 0 N--CA 1.436 -1.169 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.664 -177.526 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -72.86 122.05 7.84 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 122.61 2.206 . . . . 0.0 110.805 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 65.1 19.18 11.74 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 176.87 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -92.62 95.86 2.06 Favored Glycine 0 CA--C 1.491 -1.457 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 178.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -43.49 -51.59 6.53 Favored Glycine 0 C--O 1.22 -0.758 0 O-C-N 124.856 0.974 . . . . 0.0 115.394 -172.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -69.07 -45.62 69.87 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 117.218 0.509 . . . . 0.0 112.073 -175.414 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -69.29 -42.14 75.86 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.753 0.787 . . . . 0.0 109.558 -175.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -69.76 -35.57 75.04 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.383 -1.281 . . . . 0.0 109.643 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.4 ttt180 -68.23 -39.82 82.21 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 177.227 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -62.57 -42.72 99.72 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.779 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.9 m -58.22 -45.26 88.01 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.463 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -53.98 -53.77 48.21 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -62.13 -51.08 69.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.112 -178.471 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -69.78 -42.71 73.43 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -176.025 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.8 t -63.77 -38.68 92.01 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.687 0.279 . . . . 0.0 110.491 -177.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -76.08 -33.87 59.53 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.526 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -68.14 -38.51 82.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.646 0.736 . . . . 0.0 109.459 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . 0.438 ' HA ' ' NE ' ' A' ' 32' ' ' ARG . 4.6 tpm_? -67.32 -36.21 81.01 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.743 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.7 tp -75.37 -48.63 22.07 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.129 -177.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -101.17 114.75 29.0 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 120.997 0.427 . . . . 0.0 111.813 -173.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.2 t70 . . . . . 0 C--N 1.303 -1.449 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 175.59 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.308 0 CA-C-O 121.483 0.659 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -68.55 -49.57 58.5 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.016 -0.993 . . . . 0.0 109.698 -177.8 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.63 -37.74 88.46 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.646 -179.222 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.84 -46.46 81.81 Favored 'General case' 0 C--N 1.282 -2.334 0 CA-C-N 113.847 -1.524 . . . . 0.0 109.135 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -64.03 -51.89 62.02 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.56 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 pt -62.91 -39.15 83.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.6 t -61.69 -32.98 73.21 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-O 120.943 0.402 . . . . 0.0 109.923 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.8 tpt180 -71.56 -48.5 48.13 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 174.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -54.25 -43.84 71.28 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.639 0.587 . . . . 0.0 111.145 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -52.08 -49.02 64.36 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.838 0.711 . . . . 0.0 111.727 177.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.2 m -80.29 -23.83 40.43 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 178.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 -71.26 -32.72 69.06 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -82.0 -34.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.098 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.31 -55.14 35.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.828 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -146.45 87.46 6.48 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.8 120.28 7.29 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 121.827 1.685 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 63.97 32.54 13.0 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.336 0.654 . . . . 0.0 110.381 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.44 168.29 54.51 Favored Glycine 0 N--CA 1.437 -1.28 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.042 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.58 -92.32 2.11 Favored Glycine 0 N--CA 1.421 -2.311 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -51.28 -51.7 51.79 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 124.367 1.067 . . . . 0.0 110.846 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.17 -35.27 77.78 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.803 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -76.2 -36.0 58.82 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.391 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -61.76 -43.92 97.9 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -56.94 -51.2 70.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.767 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 m -55.49 -39.58 70.61 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.54 -54.01 50.57 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -61.17 -42.8 99.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.769 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.2 -43.81 81.2 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 177.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.1 t -67.38 -45.89 74.92 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.432 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -68.09 -27.89 66.87 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.097 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -75.73 -34.05 60.31 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.136 0.494 . . . . 0.0 110.09 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -76.28 -53.35 8.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.242 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -78.41 -48.26 15.83 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.748 -178.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 56.54 82.25 0.12 Allowed 'General case' 0 C--O 1.238 0.484 0 CA-C-O 122.231 1.015 . . . . 0.0 112.316 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--N 1.298 -1.664 0 CA-C-N 114.167 -1.379 . . . . 0.0 108.991 -179.122 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp . . . . . 0 N--CA 1.439 -1.005 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.91 -29.62 66.84 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.147 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.0 m -61.58 -40.02 93.25 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.819 178.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -50.39 68.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.165 177.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 53.0 mt -58.18 -52.07 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-O 121.323 0.582 . . . . 0.0 109.977 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.2 t -52.17 -44.7 64.78 Favored 'General case' 0 C--O 1.248 0.99 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.89 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.2 -38.42 31.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.881 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.53 -30.28 71.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -176.812 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -57.56 -51.73 68.28 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.8 m -65.91 -30.18 70.72 Favored 'General case' 0 C--O 1.192 -1.949 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.893 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.47 -29.24 69.32 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.106 0.479 . . . . 0.0 110.197 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -87.08 -47.07 16.14 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.291 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.5 tpt -71.61 -42.01 68.22 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -136.35 83.84 30.8 Favored Pre-proline 0 C--N 1.312 -1.04 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.71 119.12 4.7 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.422 2.082 . . . . 0.0 112.583 -176.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 46.61 75.87 0.11 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.654 1.182 . . . . 0.0 113.292 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.82 -143.42 9.14 Favored Glycine 0 C--N 1.301 -1.375 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -128.89 -80.45 0.27 Allowed Glycine 0 C--N 1.297 -1.619 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -64.99 -28.39 69.48 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -56.11 -43.06 77.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.076 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -70.47 -44.91 66.77 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.555 -178.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -55.96 -53.65 54.37 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 124.016 0.823 . . . . 0.0 110.342 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 mtm180 -62.4 -51.55 67.11 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.728 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 m -57.28 -48.34 79.14 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.075 0.234 . . . . 0.0 111.009 -178.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.28 -51.2 67.07 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.528 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 1.2 tm-20 -61.89 -38.26 87.69 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 124.399 1.079 . . . . 0.0 109.657 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 39.1 t -65.23 -50.72 64.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.126 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.51 -28.93 69.99 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -65.48 -36.44 83.89 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.241 0.616 . . . . 0.0 110.068 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.6 mtt180 -81.16 -55.2 4.91 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.195 0.998 . . . . 0.0 109.769 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.5 tp . . . . . 0 C--N 1.307 -1.268 0 CA-C-N 113.745 -1.57 . . . . 0.0 113.707 -168.672 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.472 ' O ' HG13 ' A' ' 6' ' ' ILE . 65.8 mttm . . . . . 0 N--CA 1.425 -1.713 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -71.39 -39.54 71.1 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.4 m -68.5 -34.18 75.44 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 113.278 -1.783 . . . . 0.0 109.077 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.51 -44.22 96.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.575 176.231 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 2' ' ' LYS . 86.5 mt -61.65 -54.94 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -48.02 -48.02 33.12 Favored 'General case' 0 C--O 1.256 1.422 0 C-N-CA 124.398 1.079 . . . . 0.0 112.093 176.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HD3' ' C ' ' A' ' 8' ' ' ARG . 1.1 tmt_? -66.96 -44.87 79.41 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 119.561 -0.257 . . . . 0.0 110.425 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -62.11 -30.8 71.27 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.353 0.597 . . . . 0.0 110.61 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -63.15 -55.67 23.28 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.355 172.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 m -64.4 -29.98 71.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -56.39 -46.84 79.93 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.039 0.936 . . . . 0.0 110.172 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 63.6 t -85.61 -48.14 16.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.123 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' MET . . . . . 0.46 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 15.3 tpt -64.92 -28.09 69.29 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -173.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -112.88 98.4 45.06 Favored Pre-proline 0 C--N 1.312 -1.065 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 14' ' ' MET . 60.6 Cg_endo -104.32 137.92 0.1 Allowed 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.417 2.744 . . . . 0.0 113.978 175.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 70.89 -17.53 0.3 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 171.126 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.447 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -90.4 105.42 3.25 Favored Glycine 0 C--N 1.304 -1.205 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.245 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.94 -34.1 87.71 Favored Glycine 0 N--CA 1.464 0.523 0 C-N-CA 121.576 -0.345 . . . . 0.0 113.121 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 4.6 mp0 -63.52 -44.4 94.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.04 -40.24 95.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.647 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 14.8 mm100 -56.73 -56.55 19.99 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.929 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -66.57 -39.35 88.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.056 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -58.1 -53.11 61.95 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 m -55.17 -41.98 72.57 Favored 'General case' 0 CA--C 1.509 -0.626 0 O-C-N 124.144 0.903 . . . . 0.0 112.868 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.21 -49.01 73.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.977 0.418 . . . . 0.0 109.941 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -64.58 -42.35 95.67 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.982 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -76.4 -27.25 56.25 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.579 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.3 t -73.12 -33.63 65.66 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -63.22 -46.08 88.63 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 171.993 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -58.38 -38.31 77.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.663 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -67.42 -40.74 85.53 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 123.713 0.805 . . . . 0.0 111.178 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 64.4 tp . . . . . 0 C--N 1.316 -0.888 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.889 -178.746 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 63.9 mttp . . . . . 0 N--CA 1.449 -0.492 0 CA-C-O 121.174 0.511 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 45.6 mt-10 -71.19 -25.73 62.65 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.01 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -76.83 -41.6 43.61 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.63 -53.28 59.95 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.397 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.3 pt -68.79 -35.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.45 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 17.5 t -57.72 -42.19 83.28 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 122.818 0.447 . . . . 0.0 110.194 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -80.56 -50.73 9.62 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.005 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.99 -39.51 71.97 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.409 0.443 . . . . 0.0 112.037 -174.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -58.04 -51.59 69.05 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 123.35 0.406 . . . . 0.0 110.066 -177.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.4 m -73.14 -34.81 66.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -61.2 -39.52 90.52 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.303 0.573 . . . . 0.0 110.575 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -82.41 -30.47 9.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.394 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 27.6 ttt -64.72 -55.2 21.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.346 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.415 ' HG3' ' OE2' ' A' ' 21' ' ' GLU . 13.9 mmmm -145.26 95.06 5.14 Favored Pre-proline 0 C--N 1.317 -0.845 0 C-N-CA 123.277 0.631 . . . . 0.0 109.558 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -74.39 123.09 7.94 Favored 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.526 2.151 . . . . 0.0 110.448 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 68.59 177.73 0.25 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.878 0.871 . . . . 0.0 111.872 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.25 -145.91 16.1 Favored Glycine 0 N--CA 1.432 -1.625 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -143.88 -73.89 0.03 OUTLIER Glycine 0 N--CA 1.437 -1.291 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.702 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.73 -43.41 93.49 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.07 0.462 . . . . 0.0 111.776 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE2' ' HG3' ' A' ' 15' ' ' LYS . 40.2 mt-10 -65.46 -27.7 68.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.209 0.528 . . . . 0.0 110.206 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -71.03 -39.05 72.56 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.358 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -64.89 -45.23 86.81 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 19.9 tpp180 -54.99 -57.32 12.18 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 123.996 0.81 . . . . 0.0 110.851 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 18.6 m -62.78 -31.85 72.9 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.09 -47.6 67.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.21 176.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.47 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 47.5 mm-40 -61.98 -49.52 75.75 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.098 177.571 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.6 t -66.7 -55.26 15.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.245 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.75 -32.65 74.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -173.849 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.31 -17.53 39.26 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.009 -1.077 . . . . 0.0 112.525 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -81.26 -40.58 23.52 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 62.7 tp . . . . . 0 C--N 1.314 -0.95 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.905 177.599 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt . . . . . 0 N--CA 1.445 -0.72 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -65.14 -27.86 69.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.171 -178.137 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.8 m -72.24 -48.08 45.49 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.399 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.93 -48.9 79.71 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.45 -40.05 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.089 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 26.2 t -55.03 -47.82 74.22 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.6 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -80.02 -39.25 30.31 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.501 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.7 tt0 -58.74 -37.62 76.6 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.5 0.72 . . . . 0.0 111.799 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -60.02 -52.23 66.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.88 -28.66 65.83 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.885 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 46.6 tt0 -57.89 -47.3 83.18 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 124.023 0.929 . . . . 0.0 110.079 177.136 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.0 m -87.05 -25.1 6.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.877 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 50.1 tpp -75.96 -49.24 18.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.479 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -134.85 80.57 48.83 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -178.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -71.87 118.66 5.75 Favored 'Trans proline' 0 C--O 1.248 0.987 0 C-N-CA 121.749 1.633 . . . . 0.0 111.249 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 59.68 20.43 9.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.943 0.897 . . . . 0.0 112.702 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -87.26 75.51 2.15 Favored Glycine 0 C--O 1.217 -0.925 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -30.11 -54.83 0.22 Allowed Glycine 0 N--CA 1.479 1.535 0 C-N-CA 126.212 1.863 . . . . 0.0 117.093 -173.47 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.78 -55.81 26.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 117.87 0.835 . . . . 0.0 111.399 -177.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.68 -21.53 60.23 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.819 -177.32 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 30.1 tt0 -72.78 -41.73 64.69 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.616 176.233 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -70.93 -30.57 66.93 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 175.738 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 20.6 tpp180 -57.93 -50.24 74.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.695 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.6 m -58.67 -40.47 83.6 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.402 175.474 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 15.0 mm100 -59.37 -47.59 84.84 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.043 0.214 . . . . 0.0 110.472 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -60.34 -49.59 76.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.98 0.8 . . . . 0.0 110.276 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 44.2 mt-10 -64.33 -34.07 77.3 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.1 t -70.02 -41.48 74.24 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 46.6 mt-10 -63.21 -40.97 98.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -19.36 61.59 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.118 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -86.05 -50.42 7.05 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.088 0.471 . . . . 0.0 110.289 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.9 mt . . . . . 0 C--N 1.318 -0.763 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.389 -175.679 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp . . . . . 0 N--CA 1.444 -0.729 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.55 -31.37 72.52 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.424 0.63 . . . . 0.0 110.237 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.3 m -79.08 -33.43 44.53 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.949 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -63.16 -51.6 65.78 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.33 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 69.2 mt -56.3 -46.31 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.2 t -54.2 -51.0 65.79 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 113.855 -1.521 . . . . 0.0 112.041 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -65.55 -43.0 91.24 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.528 -0.108 . . . . 0.0 110.773 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -61.25 -39.27 89.74 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -61.96 -54.39 42.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 123.575 0.547 . . . . 0.0 109.525 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 m -64.24 -29.91 70.98 Favored 'General case' 0 C--O 1.203 -1.395 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -66.06 -40.87 91.26 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 120.896 0.379 . . . . 0.0 110.765 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.8 p -89.06 -38.6 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 94.5 mmm -80.59 -25.33 38.55 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.17 96.13 49.82 Favored Pre-proline 0 C--N 1.309 -1.184 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -94.66 120.0 0.29 Allowed 'Trans proline' 0 N--CA 1.445 -1.377 0 C-N-CA 122.067 1.844 . . . . 0.0 111.989 176.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 68.28 -176.21 0.2 Allowed 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.908 0.883 . . . . 0.0 112.048 176.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.17 -41.68 2.16 Favored Glycine 0 C--N 1.297 -1.599 0 C-N-CA 121.208 -0.52 . . . . 0.0 111.805 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.63 -64.52 3.83 Favored Glycine 0 C--N 1.301 -1.405 0 C-N-CA 121.329 -0.462 . . . . 0.0 112.285 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.27 -40.24 81.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.053 0.541 . . . . 0.0 111.093 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.87 -36.17 82.42 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.649 0.738 . . . . 0.0 109.178 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -72.4 -41.2 66.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.698 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 29.0 tpt180 -56.34 -50.16 72.28 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.052 -0.977 . . . . 0.0 108.949 176.597 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -59.01 -42.24 89.65 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.304 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 m -54.3 -54.99 32.79 Favored 'General case' 0 C--O 1.215 -0.742 0 O-C-N 123.674 0.609 . . . . 0.0 112.021 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.78 -33.64 75.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 14.0 mm100 -62.12 -49.75 74.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -70.88 -29.62 65.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.518 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.2 t -63.79 -51.69 63.63 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.423 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.55 -25.31 62.16 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.66 -42.38 95.44 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -68.47 -37.93 80.59 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.925 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 53.5 tp . . . . . 0 C--O 1.24 0.584 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.204 176.49 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 6' ' ' ILE . 98.8 mttt . . . . . 0 N--CA 1.445 -0.702 0 CA-C-O 120.562 0.22 . . . . 0.0 111.32 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -68.86 -32.74 72.62 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.9 m -64.88 -43.79 91.79 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.077 -1.42 . . . . 0.0 109.554 176.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.44 -43.76 93.29 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.274 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.4 mt -61.55 -50.39 80.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 t -51.52 -43.53 62.31 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.008 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -72.91 -46.48 52.4 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.222 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -59.14 -41.89 89.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -174.311 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 78.6 t90 -55.5 -48.38 74.7 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.609 0.568 . . . . 0.0 110.327 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -77.65 -30.02 51.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.733 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -67.45 -41.39 84.79 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.963 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.1 p -84.02 -20.68 8.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-O 121.176 0.513 . . . . 0.0 110.01 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 22.4 ttt -60.95 -54.49 44.32 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -153.62 101.12 2.55 Favored Pre-proline 0 N--CA 1.428 -1.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.977 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.29 119.64 6.89 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.96 1.773 . . . . 0.0 108.978 173.678 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 59.53 74.6 0.44 Allowed 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 111.398 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -105.54 164.14 14.04 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.8 -92.15 2.07 Favored Glycine 0 N--CA 1.425 -2.06 0 C-N-CA 120.87 -0.681 . . . . 0.0 111.992 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.56 -46.87 83.94 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.452 0.701 . . . . 0.0 111.75 -174.491 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -65.36 -38.32 89.71 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 120.789 0.328 . . . . 0.0 111.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 26.3 tt0 -70.45 -32.9 70.65 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -64.2 -42.19 96.74 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -57.68 -48.17 80.26 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.485 174.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.3 m -55.74 -40.69 72.86 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.72 178.031 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.507 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 78.1 mt-30 -57.34 -51.22 70.29 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 123.349 0.405 . . . . 0.0 109.991 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.54 -49.56 73.0 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.052 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.34 -47.94 83.87 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.06 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 7.7 t -63.02 -42.75 99.88 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 122.941 0.15 . . . . 0.0 110.985 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 49.1 mt-10 -64.7 -39.96 94.55 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.953 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -87.15 -29.29 21.91 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.286 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -80.52 -44.46 19.07 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.104 0.478 . . . . 0.0 110.617 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 29' ' ' CYS . 45.1 tp . . . . . 0 C--N 1.307 -1.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.219 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 86.5 tttt . . . . . 0 N--CA 1.443 -0.798 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.25 -26.45 67.36 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.338 0.589 . . . . 0.0 110.699 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.1 m -70.48 -47.88 58.44 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.372 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -62.67 -49.36 75.44 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.776 -177.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.11 -53.33 44.64 Favored 'Isoleucine or valine' 0 C--O 1.245 0.833 0 CA-C-O 121.619 0.723 . . . . 0.0 109.662 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.25 -49.26 77.73 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.372 -1.285 . . . . 0.0 112.253 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -67.51 -41.56 84.25 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -56.57 -36.79 69.75 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 123.312 0.382 . . . . 0.0 110.614 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -59.66 -49.87 76.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.9 m -74.21 -27.34 60.74 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.924 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -69.62 -43.6 72.37 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.4 p -78.16 -20.46 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.338 0.589 . . . . 0.0 109.837 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 47.8 tpp -71.15 -49.38 44.55 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.688 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -151.88 107.88 2.86 Favored Pre-proline 0 N--CA 1.43 -1.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.311 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -57.58 139.78 91.3 Favored 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.704 2.269 . . . . 0.0 109.566 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 68.13 -67.21 0.2 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.683 1.193 . . . . 0.0 109.944 -172.059 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.484 ' HA3' ' HB2' ' A' ' 22' ' ' GLN . . . 87.71 -52.87 4.26 Favored Glycine 0 N--CA 1.436 -1.306 0 CA-C-N 116.578 -0.283 . . . . 0.0 112.919 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.39 -114.84 6.58 Favored Glycine 0 C--N 1.308 -1.009 0 N-CA-C 110.494 -1.043 . . . . 0.0 110.494 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -67.4 -29.04 68.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 117.153 0.477 . . . . 0.0 110.371 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.94 -31.37 66.27 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.158 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.484 ' HB2' ' HA3' ' A' ' 18' ' ' GLY . 4.4 tp-100 -76.17 -36.86 58.5 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.561 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 68.7 mtt180 -65.61 -39.36 91.45 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.298 176.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -64.42 -43.76 93.35 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.1 m -60.32 -39.52 87.34 Favored 'General case' 0 C--O 1.2 -1.503 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.403 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -58.22 -46.2 86.31 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.296 0.638 . . . . 0.0 109.973 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 23' ' ' ARG . 87.7 mt-30 -55.73 -52.87 62.42 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.802 0.689 . . . . 0.0 109.612 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -65.89 -39.6 90.79 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.357 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 t -65.42 -43.46 90.42 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 122.905 0.482 . . . . 0.0 110.263 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -62.85 -47.1 84.82 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.832 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.49 -38.32 86.87 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.456 0.702 . . . . 0.0 110.979 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -63.47 -45.42 90.89 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 123.813 0.845 . . . . 0.0 110.317 175.642 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.1 tp . . . . . 0 C--N 1.315 -0.928 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.439 -177.454 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 10.1 mtmp? . . . . . 0 CA--C 1.515 -0.392 0 CA-C-O 121.747 0.784 . . . . 0.0 108.946 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLU . . . . . 0.591 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 2.1 mp0 -54.25 -52.38 61.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 125.864 1.666 . . . . 0.0 109.574 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 p -72.85 -34.92 67.09 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 113.197 -1.819 . . . . 0.0 111.824 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.14 -52.27 66.44 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 122.593 0.357 . . . . 0.0 110.464 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 78.0 mt -60.88 -50.78 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.5 t -52.98 -47.0 68.51 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 114.131 -1.395 . . . . 0.0 111.18 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -61.92 -48.29 81.08 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 123.863 0.865 . . . . 0.0 110.529 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -61.72 -37.5 84.42 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.925 0.765 . . . . 0.0 111.686 -175.106 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -56.71 -53.04 62.31 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 121.477 0.656 . . . . 0.0 109.738 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.7 m -66.66 -37.61 85.14 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -64.79 -44.3 90.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.394 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.5 p -73.16 -29.86 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.156 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 17.2 tpt -69.42 -54.66 13.25 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.511 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -148.87 108.11 3.47 Favored Pre-proline 0 C--N 1.321 -0.672 0 C-N-CA 123.751 0.82 . . . . 0.0 109.604 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -66.5 119.45 6.48 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 121.82 1.68 . . . . 0.0 111.668 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 51.11 -95.43 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 126.177 1.791 . . . . 0.0 114.272 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.48 -115.24 5.55 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -161.88 -80.61 0.04 OUTLIER Glycine 0 N--CA 1.415 -2.712 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.0 -31.86 73.3 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -70.75 -41.07 72.28 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.66 -37.92 65.13 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.481 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.473 ' HD3' ' OE1' ' A' ' 26' ' ' GLN . 39.9 mmt180 -63.93 -41.04 97.74 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.078 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.445 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 51.0 ttp180 -63.68 -46.7 84.36 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.075 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 43.9 m -57.89 -34.48 69.84 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.473 ' OE1' ' HD3' ' A' ' 23' ' ' ARG . 54.6 mt-30 -60.64 -49.63 76.74 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.364 0.529 . . . . 0.0 110.355 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -62.41 -46.79 86.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.474 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 23.2 mm-40 -63.3 -46.91 84.53 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.191 0.596 . . . . 0.0 111.689 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 10.5 t -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 122.774 0.43 . . . . 0.0 111.0 -175.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.15 -25.09 61.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.604 -0.439 . . . . 0.0 110.656 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.31 -39.58 85.91 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 174.66 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.589 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 13.1 mmt180 -67.6 -38.08 83.49 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.55 176.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.9 tp . . . . . 0 C--N 1.309 -1.168 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.729 -179.807 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.3 mttt . . . . . 0 C--O 1.252 1.2 0 CA-C-O 120.954 0.407 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -79.05 -13.61 59.66 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.768 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.7 m -65.54 -45.17 84.42 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -59.25 -47.27 85.99 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.203 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.2 -54.88 26.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.072 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.3 t -54.98 -48.74 72.89 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.418 -1.264 . . . . 0.0 111.796 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -66.95 -46.96 73.12 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.118 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.411 ' O ' HG22 ' A' ' 13' ' ' VAL . 6.8 tp60 -57.46 -38.52 74.61 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.594 0.559 . . . . 0.0 110.584 -177.172 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -54.94 -54.93 36.44 Favored 'General case' 0 C--O 1.249 1.057 0 C-N-CA 123.666 0.786 . . . . 0.0 110.746 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.4 m -70.8 -36.22 72.9 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.075 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -61.33 -39.33 90.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.814 0.846 . . . . 0.0 111.547 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 9' ' ' GLN . 34.1 m -83.14 -30.87 8.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 61.0 mtm -77.83 -54.09 6.74 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 119.368 -0.933 . . . . 0.0 111.9 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -156.7 91.37 2.52 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.0 128.74 8.54 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.26 1.973 . . . . 0.0 113.036 -177.795 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 69.22 127.14 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.924 1.29 . . . . 0.0 113.678 175.531 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -177.56 164.17 33.11 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 109.234 -1.547 . . . . 0.0 109.234 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.33 -86.87 0.28 Allowed Glycine 0 N--CA 1.438 -1.222 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.351 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' A' ' 23' ' ' ARG . 5.9 tp10 -70.35 -33.12 71.09 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -178.708 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.11 -60.21 4.09 Favored 'General case' 0 C--O 1.245 0.859 0 C-N-CA 123.895 0.878 . . . . 0.0 110.922 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 56.2 tp60 -72.39 -23.83 61.16 Favored 'General case' 0 C--O 1.2 -1.549 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.019 -177.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.546 ' HD3' ' OE2' ' A' ' 20' ' ' GLU . 33.6 ttt180 -62.8 -33.96 76.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -63.09 -48.7 77.48 Favored 'General case' 0 CA--C 1.502 -0.878 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 175.433 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.9 m -58.75 -38.45 78.44 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.211 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 14.2 mm100 -61.38 -48.86 79.34 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 177.948 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 31' ' ' GLU . 76.9 mt-30 -63.4 -43.77 96.58 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.9 0.381 . . . . 0.0 111.586 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.648 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 6.8 mm-40 -67.48 -53.32 29.76 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.156 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.5 t -67.3 -51.95 46.37 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.192 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.82 -26.76 64.4 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -174.864 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -79.42 -27.51 41.76 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.016 176.699 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.648 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 34.3 mtm180 -81.44 -38.89 25.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.263 0.554 . . . . 0.0 110.206 178.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.4 mt . . . . . 0 C--N 1.309 -1.182 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.857 179.55 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.426 ' O ' HG13 ' A' ' 6' ' ' ILE . 66.3 mttm . . . . . 0 CA--C 1.509 -0.616 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.95 -41.12 82.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.447 0.641 . . . . 0.0 109.415 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.2 m -58.76 -42.83 89.8 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.253 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.38 -45.25 91.94 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.496 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 2' ' ' LYS . 58.6 mt -63.99 -50.48 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.908 0.861 . . . . 0.0 108.741 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.0 t -52.8 -45.91 67.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.864 -1.516 . . . . 0.0 112.414 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -30.81 51.65 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.526 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.511 ' O ' HG23 ' A' ' 13' ' ' VAL . 23.2 tp60 -60.2 -42.85 95.97 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 90.8 t90 -55.72 -43.84 76.91 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 123.649 0.78 . . . . 0.0 109.849 177.092 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.4 m -68.97 -36.71 78.2 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.65 -28.73 70.11 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 120.964 0.411 . . . . 0.0 111.334 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 9' ' ' GLN . 88.0 t -75.24 -38.97 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 121.446 0.641 . . . . 0.0 109.347 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.3 ttt -68.62 -54.66 15.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.737 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -156.46 101.59 2.04 Favored Pre-proline 0 C--N 1.307 -1.28 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -57.91 118.72 5.65 Favored 'Trans proline' 0 C--O 1.252 1.195 0 C-N-CA 122.406 2.071 . . . . 0.0 111.202 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 53.88 51.85 14.05 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.259 0.974 . . . . 0.0 110.405 -177.213 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.96 164.58 51.6 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.898 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.36 -95.92 0.3 Allowed Glycine 0 N--CA 1.432 -1.627 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -69.45 -26.21 64.48 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.648 -178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -59.22 -56.88 16.54 Favored 'General case' 0 C--O 1.217 -0.606 0 O-C-N 123.546 0.529 . . . . 0.0 110.656 176.501 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -67.24 -29.73 69.44 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -176.18 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 25.5 mmm180 -63.98 -56.61 13.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.352 174.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -59.73 -40.79 89.23 Favored 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 123.414 0.447 . . . . 0.0 109.812 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.645 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 21.9 m -49.81 -56.95 8.44 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 124.243 0.964 . . . . 0.0 111.052 173.424 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -65.78 -33.93 77.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 15.6 mm100 -57.96 -51.01 71.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.261 0.351 . . . . 0.0 111.174 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.35 -29.45 42.23 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.979 0.418 . . . . 0.0 111.163 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.645 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.6 t -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.417 0.687 . . . . 0.0 109.21 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -74.07 -28.06 61.2 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.434 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 14.8 tp10 -61.4 -46.24 91.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.019 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -74.39 -33.3 63.0 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.515 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.6 tp . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.441 -179.208 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 57.1 tptt . . . . . 0 N--CA 1.439 -1.021 0 CA-C-O 120.882 0.373 . . . . 0.0 110.656 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.98 -31.61 69.39 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.37 -178.833 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -64.47 -49.0 73.14 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.819 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.585 ' O ' ' HG3' ' A' ' 9' ' ' GLN . 8.3 tp10 -60.89 -48.97 79.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.215 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 82.6 mt -55.72 -52.91 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 CA-C-O 121.29 0.567 . . . . 0.0 109.667 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.9 t -52.39 -47.05 66.44 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.665 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -68.72 -35.72 77.51 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.614 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 5' ' ' GLU . 57.4 mt-30 -57.9 -37.67 74.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 118.158 0.435 . . . . 0.0 111.111 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.51 -50.62 73.09 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.057 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 m -82.04 -13.2 57.69 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -67.9 -34.18 76.14 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.7 t -79.6 -39.72 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.252 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.3 mmt -68.35 -55.23 12.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -136.6 87.04 21.59 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-O 120.871 0.367 . . . . 0.0 111.144 -176.219 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -88.49 120.15 1.2 Allowed 'Trans proline' 0 N--CA 1.443 -1.489 0 C-N-CA 122.643 2.229 . . . . 0.0 110.476 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 64.55 90.59 0.08 Allowed 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.872 1.269 . . . . 0.0 111.546 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.91 -173.17 20.68 Favored Glycine 0 N--CA 1.434 -1.447 0 C-N-CA 120.186 -1.006 . . . . 0.0 112.216 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.0 -96.25 2.24 Favored Glycine 0 N--CA 1.429 -1.801 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -63.34 -41.44 98.87 Favored 'General case' 0 C--O 1.207 -1.162 0 C-N-CA 122.979 0.512 . . . . 0.0 111.126 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -66.64 -32.56 73.95 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.265 0.555 . . . . 0.0 111.161 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -76.21 -37.93 57.13 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -64.58 -38.98 92.88 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.876 175.68 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -54.99 -52.22 63.77 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.573 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 m -64.97 -33.51 76.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.037 177.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.28 -48.85 63.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -61.03 -45.3 95.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.156 0.582 . . . . 0.0 109.607 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -53.23 -47.2 69.2 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.809 173.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.2 t -70.57 -41.01 72.98 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.277 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -60.7 -45.04 95.7 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.954 0.407 . . . . 0.0 110.52 177.972 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -68.57 -22.45 64.47 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.643 0.735 . . . . 0.0 110.941 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -87.88 -34.76 18.07 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.546 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.8 tp . . . . . 0 C--N 1.31 -1.149 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.679 179.053 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -61.24 -46.84 88.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.81 0.814 . . . . 0.0 110.398 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.0 m -74.51 -23.27 58.81 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.585 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.4 -51.01 61.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.772 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.27 -32.64 56.61 Favored 'Isoleucine or valine' 0 C--O 1.251 1.175 0 CA-C-O 121.492 0.663 . . . . 0.0 109.329 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.12 -48.17 82.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.797 175.218 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.2 ttt180 -64.86 -40.99 96.01 Favored 'General case' 0 C--O 1.213 -0.858 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.195 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -50.33 -37.38 36.42 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.524 1.13 . . . . 0.0 111.706 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.7 t90 -57.93 -49.18 77.63 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 121.744 0.783 . . . . 0.0 109.766 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.5 m -78.77 -31.06 45.96 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.195 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -63.6 -43.9 95.56 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 123.786 0.835 . . . . 0.0 109.932 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 p -78.14 -29.74 15.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.409 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.9 ttp -60.93 -55.1 36.99 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -157.12 108.05 1.9 Allowed Pre-proline 0 N--CA 1.439 -0.999 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.5 119.85 7.05 Favored 'Trans proline' 0 C--O 1.25 1.116 0 C-N-CA 122.121 1.881 . . . . 0.0 111.471 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 69.46 173.35 0.3 Allowed 'General case' 0 C--O 1.252 1.208 0 C-N-CA 124.51 1.124 . . . . 0.0 112.507 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 155.36 166.67 15.86 Favored Glycine 0 N--CA 1.421 -2.312 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 177.583 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.94 -87.79 1.06 Allowed Glycine 0 C--N 1.295 -1.731 0 C-N-CA 119.872 -1.156 . . . . 0.0 110.692 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 24' ' ' ARG . 39.0 mt-10 -67.96 -37.17 81.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.929 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.456 ' CD ' ' H ' ' A' ' 21' ' ' GLU . 1.8 mp0 -54.95 -42.18 72.0 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 123.648 0.592 . . . . 0.0 110.394 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -71.55 -38.62 70.98 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.727 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -68.09 -33.94 75.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.161 0.505 . . . . 0.0 109.966 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 91.8 mtt180 -65.48 -54.48 27.7 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.595 177.04 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.02 -37.27 74.01 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -59.01 -51.55 69.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 177.062 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -63.4 -46.73 85.06 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 32.7 mm-40 -55.22 -47.52 75.2 Favored 'General case' 0 C--O 1.217 -0.612 0 O-C-N 123.59 0.556 . . . . 0.0 110.645 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.7 t -59.45 -44.18 93.0 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.584 -178.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.12 -40.14 86.78 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.89 -30.58 61.34 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.5 mtt180 -73.2 -43.62 61.04 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.1 tp . . . . . 0 C--N 1.315 -0.929 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.081 176.053 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -69.16 -30.08 68.24 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 121.641 0.734 . . . . 0.0 110.015 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 4' ' ' THR . . . . . 0.422 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 26.4 m -78.35 -32.95 49.32 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.234 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -63.1 -52.24 63.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.799 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.8 pt -66.17 -33.87 66.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.237 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 4' ' ' THR . 38.1 t -52.45 -47.58 66.35 Favored 'General case' 0 C--O 1.245 0.823 0 O-C-N 123.88 0.738 . . . . 0.0 111.041 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -78.39 -41.85 32.0 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.369 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -56.96 -41.25 78.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -59.02 -51.6 69.38 Favored 'General case' 0 N--CA 1.443 -0.779 0 O-C-N 123.757 0.661 . . . . 0.0 109.263 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.9 m -64.31 -39.58 94.19 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.369 178.62 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -60.46 -45.4 93.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.057 0.456 . . . . 0.0 111.217 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 88.0 t -77.0 -45.86 30.0 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.401 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 16.3 tpt -70.02 -49.49 50.81 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.869 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.465 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 16.5 ptpt -130.56 79.7 71.63 Favored Pre-proline 0 C--N 1.308 -1.216 0 CA-C-O 121.734 0.778 . . . . 0.0 112.015 -175.111 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -82.94 120.66 3.06 Favored 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 122.87 2.38 . . . . 0.0 111.732 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 69.23 99.95 0.06 Allowed 'General case' 0 C--O 1.241 0.623 0 C-N-CA 124.989 1.316 . . . . 0.0 111.735 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -158.82 167.77 34.82 Favored Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 178.659 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.02 -90.95 1.63 Allowed Glycine 0 N--CA 1.431 -1.692 0 C-N-CA 120.382 -0.914 . . . . 0.0 111.384 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -64.42 -31.45 72.67 Favored 'General case' 0 C--O 1.214 -0.799 0 C-N-CA 122.33 0.252 . . . . 0.0 111.667 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 67.5 mm-40 -60.88 -50.81 71.93 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 120.809 0.338 . . . . 0.0 111.573 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -75.18 -32.86 61.37 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.967 0.413 . . . . 0.0 109.933 -178.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.03 -42.03 98.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.318 0.58 . . . . 0.0 109.595 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -63.35 -44.12 95.74 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.826 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 28.7 m -55.95 -47.12 78.18 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.454 0.471 . . . . 0.0 110.781 174.513 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -55.21 -56.67 17.32 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.52 0.513 . . . . 0.0 111.082 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -60.81 -46.72 89.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.356 -176.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -63.14 -41.44 99.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.208 0.527 . . . . 0.0 110.445 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.4 t -65.68 -45.35 83.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.09 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.66 -27.97 62.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.207 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -71.67 -36.39 70.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -70.28 -38.02 74.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.7 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.2 tp . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.692 179.585 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 CA--C 1.506 -0.736 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.65 -30.62 70.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.345 0.593 . . . . 0.0 110.059 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.4 m -69.78 -36.55 75.83 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.561 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.59 -50.49 67.01 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.835 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.34 -50.42 80.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.932 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.9 t -50.47 -44.47 55.72 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.201 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -74.62 -48.82 24.25 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.975 177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -54.7 -39.5 68.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.321 0.648 . . . . 0.0 111.99 -176.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 77.9 t90 -55.07 -52.97 61.52 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 123.78 0.675 . . . . 0.0 110.182 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -75.94 -32.21 59.45 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -56.63 -46.71 80.81 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.623 0.769 . . . . 0.0 110.602 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -86.01 -38.9 13.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.403 -177.125 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 15.1 tpt -62.23 -40.4 96.02 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.804 0.335 . . . . 0.0 111.624 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -127.3 108.84 21.31 Favored Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.075 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -54.91 158.59 10.85 Favored 'Trans proline' 0 C--O 1.25 1.101 0 C-N-CA 122.938 2.425 . . . . 0.0 111.261 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -63.81 112.51 2.92 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.505 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -128.67 -91.96 0.69 Allowed Glycine 0 N--CA 1.426 -1.968 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.03 -80.47 0.04 OUTLIER Glycine 0 C--N 1.302 -1.346 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.936 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -57.52 -39.65 77.02 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 123.061 0.545 . . . . 0.0 110.769 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 21' ' ' GLU . 1.3 mp0 -50.42 -54.95 18.13 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 124.632 1.173 . . . . 0.0 110.304 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -67.83 -37.98 82.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.531 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -61.24 -47.49 85.83 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -63.34 -46.67 85.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.004 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.2 m -62.25 -31.81 72.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -66.67 -43.75 83.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -64.59 -48.71 73.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.087 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 60.3 mm-40 -59.46 -43.72 93.13 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.958 177.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -59.6 -57.82 11.26 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.492 0.495 . . . . 0.0 110.74 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -57.7 -39.93 78.32 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.57 -43.31 97.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.647 -178.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 51.0 mtt180 -89.42 -28.69 19.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.656 -175.762 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.2 tp . . . . . 0 C--N 1.308 -1.22 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.168 -179.779 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 120.631 0.253 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.52 -31.45 72.18 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.975 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.0 m -72.07 -36.46 69.56 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -67.69 -52.93 32.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.645 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.54 -38.07 81.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.3 t -58.74 -42.94 89.97 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.877 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 8' ' ' ARG . 8.6 tpt180 -75.71 -45.24 37.82 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.909 178.415 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.74 -31.83 72.84 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.144 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -59.85 -49.17 78.75 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.769 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 70.2 m -66.67 -43.57 84.14 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.762 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -59.29 -42.41 91.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.968 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.7 m -86.11 -19.64 8.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.35 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.2 ttt -75.08 -47.94 26.34 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.307 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -156.37 99.07 2.12 Favored Pre-proline 0 N--CA 1.438 -1.059 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.123 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -85.66 120.08 2.01 Favored 'Trans proline' 0 N--CA 1.451 -1.02 0 C-N-CA 122.609 2.206 . . . . 0.0 110.549 176.114 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -164.59 -51.6 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.31 0.576 . . . . 0.0 110.635 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.47 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 105.49 -137.06 13.54 Favored Glycine 0 N--CA 1.416 -2.658 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 -174.859 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.551 ' O ' ' HG2' ' A' ' 23' ' ' ARG . . . 55.58 -135.99 47.65 Favored Glycine 0 C--O 1.246 0.898 0 O-C-N 123.934 0.432 . . . . 0.0 113.71 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.37 -30.11 63.07 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 122.693 0.397 . . . . 0.0 110.591 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -58.92 -43.85 91.19 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.954 0.883 . . . . 0.0 108.717 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.47 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 9.6 tt0 -69.96 -39.02 76.26 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.45 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 19' ' ' GLY . 30.9 mmm180 -61.8 -44.18 97.37 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 34.9 mmt180 -61.65 -49.67 75.6 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.529 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 24.6 m -62.13 -37.31 84.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 177.202 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -57.67 -52.98 63.2 Favored 'General case' 0 C--O 1.245 0.821 0 C-N-CA 122.935 0.494 . . . . 0.0 110.5 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -55.56 -58.86 6.05 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.486 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.8 pt-20 -66.68 -33.69 76.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.273 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 10.1 t -65.54 -52.53 51.74 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.365 0.126 . . . . 0.0 110.704 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -72.39 -25.93 61.69 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.38 -42.68 64.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -67.94 -37.76 82.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.119 177.744 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.5 tp . . . . . 0 C--N 1.31 -1.148 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.766 179.964 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt . . . . . 0 N--CA 1.446 -0.631 0 CA-C-O 120.749 0.309 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.73 -27.35 61.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 121.598 0.713 . . . . 0.0 110.974 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 m -74.7 -33.49 62.44 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.796 178.142 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -62.63 -47.74 82.4 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.04 176.949 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.7 -47.85 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.572 176.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.5 t -46.98 -46.58 21.73 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.944 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -70.22 -45.67 66.07 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.38 176.082 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -56.0 -35.15 66.48 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.288 0.367 . . . . 0.0 111.818 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -60.97 -55.41 33.29 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.071 0.462 . . . . 0.0 110.035 176.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.25 -32.56 72.84 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.518 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -57.28 -48.82 77.91 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 123.554 0.742 . . . . 0.0 110.631 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.7 t -79.53 -39.63 20.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.321 -0.854 . . . . 0.0 112.268 -176.498 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 60.0 mtt -84.0 -27.51 28.36 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.476 ' CG ' ' HB3' ' A' ' 21' ' ' GLU . 4.7 mptp? -108.91 107.35 59.96 Favored Pre-proline 0 C--N 1.308 -1.231 0 O-C-N 122.249 -0.282 . . . . 0.0 110.296 -177.241 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.56 121.19 8.68 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 123.507 2.805 . . . . 0.0 113.335 -178.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 68.3 -66.72 0.22 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.004 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.43 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 155.2 -120.95 1.05 Allowed Glycine 0 N--CA 1.424 -2.128 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.783 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.6 -143.98 26.25 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -56.2 -32.5 64.44 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.019 0.438 . . . . 0.0 111.214 177.642 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HB3' ' CG ' ' A' ' 15' ' ' LYS . 33.1 mm-40 -61.61 -40.69 95.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.672 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.43 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 36.1 tt0 -76.78 -34.45 58.0 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.594 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.71 -50.64 71.62 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.249 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.8 ttt180 -59.9 -45.76 91.49 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.158 177.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 31.5 m -59.27 -39.8 84.06 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 50.1 tt0 -62.29 -49.17 76.71 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.781 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.02 -52.48 63.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.766 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -68.21 -29.03 67.77 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.3 t -71.94 -43.56 65.05 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 58.8 mt-10 -68.79 -32.65 72.53 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.083 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.66 -38.34 83.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.657 0.741 . . . . 0.0 109.528 177.603 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -79.04 -34.05 44.18 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.961 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.9 tp . . . . . 0 C--N 1.311 -1.102 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.286 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.506 ' O ' HG13 ' A' ' 6' ' ' ILE . 67.0 mttm . . . . . 0 N--CA 1.431 -1.409 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.57 -40.2 80.66 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-O 121.635 0.731 . . . . 0.0 109.628 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 m -75.07 -32.6 61.54 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-N 114.383 -1.281 . . . . 0.0 108.886 178.493 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -58.94 -52.1 67.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.103 177.14 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.6 mt -57.93 -48.14 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.4 t -49.44 -53.8 20.97 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-N 114.148 -1.387 . . . . 0.0 111.916 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.05 -37.98 69.58 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.453 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -56.12 -41.21 74.92 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.866 0.466 . . . . 0.0 110.302 -179.261 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -60.76 -46.61 89.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.793 178.965 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.7 m -71.26 -30.61 66.51 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -64.91 -32.34 74.0 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.672 0.748 . . . . 0.0 109.929 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.4 t -85.71 -46.65 16.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.762 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.4 mmt -74.42 -39.29 62.71 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -176.567 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.471 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 64.7 mttm -131.3 74.61 78.78 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 122.872 0.469 . . . . 0.0 109.905 -177.437 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -87.58 120.18 1.44 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.688 2.259 . . . . 0.0 112.514 -176.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 63.82 -176.6 0.16 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.454 1.102 . . . . 0.0 111.655 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.65 -97.41 0.93 Allowed Glycine 0 C--N 1.29 -1.986 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . 0.489 ' O ' ' HG3' ' A' ' 23' ' ' ARG . . . 176.5 -91.6 0.08 OUTLIER Glycine 0 N--CA 1.426 -1.998 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.298 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.88 -45.09 70.96 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 -173.164 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 28.4 mm-40 -67.72 -35.57 79.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.048 0.451 . . . . 0.0 111.415 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.62 -38.93 70.74 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.158 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 19' ' ' GLY . 73.7 mtp180 -61.26 -42.79 99.23 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.966 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -61.83 -42.55 99.17 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.288 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.439 ' SG ' ' HD2' ' A' ' 15' ' ' LYS . 1.8 m -64.74 -34.92 79.45 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 34.8 tt0 -63.31 -50.6 69.4 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.398 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.12 -49.31 78.15 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.975 178.384 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -53.01 -49.44 66.22 Favored 'General case' 0 CA--C 1.498 -1.034 0 C-N-CA 123.891 0.876 . . . . 0.0 112.881 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 5.9 t -68.0 -34.48 76.6 Favored 'General case' 0 C--N 1.308 -1.225 0 O-C-N 123.55 0.531 . . . . 0.0 110.607 -175.676 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 12.2 mm-40 -68.85 -38.96 80.14 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.792 178.862 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -76.13 -18.76 59.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.989 0.423 . . . . 0.0 110.991 178.371 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -85.55 -54.58 4.47 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.199 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 C--N 1.317 -0.841 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.706 -178.26 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 5' ' ' GLU . 74.0 mmtt . . . . . 0 N--CA 1.44 -0.93 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -78.48 -26.62 46.08 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.124 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.6 m -72.27 -32.34 66.55 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.397 175.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 2' ' ' LYS . 13.3 tp10 -62.06 -52.15 65.08 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.875 175.743 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 2' ' ' LYS . 61.2 mt -58.01 -50.41 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 121.396 0.617 . . . . 0.0 109.553 178.388 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.0 t -54.12 -48.17 71.04 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.346 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -69.92 -39.24 76.26 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.099 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -58.38 -38.62 77.67 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 178.018 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' TRP . . . . . 0.413 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 82.9 t90 -59.18 -55.06 39.76 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' SG ' ' HE3' ' A' ' 10' ' ' TRP . 96.4 m -67.41 -34.07 76.48 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -58.8 -45.88 88.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.031 0.443 . . . . 0.0 110.597 178.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.8 p -82.17 -35.16 12.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.178 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.52 -47.94 57.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.008 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -126.79 96.09 35.96 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.353 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -64.51 141.17 72.53 Favored 'Trans proline' 0 C--O 1.244 0.792 0 C-N-CA 122.157 1.905 . . . . 0.0 110.061 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 75.67 -53.44 0.63 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.417 1.487 . . . . 0.0 110.758 -176.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.6 -78.79 0.33 Allowed Glycine 0 N--CA 1.43 -1.766 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.213 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.05 -119.22 12.71 Favored Glycine 0 C--N 1.307 -1.083 0 N-CA-C 112.058 -0.417 . . . . 0.0 112.058 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -66.85 -34.13 77.12 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.79 0.805 . . . . 0.0 109.036 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.66 -18.53 60.52 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.646 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.439 HE22 ' NE2' ' A' ' 26' ' ' GLN . 18.7 tm0? -67.4 -45.53 75.88 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.201 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 23' ' ' ARG . 17.6 mmm180 -59.81 -48.98 79.51 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 124.152 0.908 . . . . 0.0 109.584 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ARG . . . . . 0.555 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 71.7 ttt180 -57.66 -56.87 16.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.482 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 10.7 m -57.36 -44.58 84.48 Favored 'General case' 0 C--O 1.204 -1.293 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.439 ' NE2' HE22 ' A' ' 22' ' ' GLN . 36.0 tt0 -63.47 -40.66 97.71 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -64.65 -44.65 89.77 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.564 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.0 mm-40 -71.77 -29.52 64.57 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.071 0.462 . . . . 0.0 110.066 179.316 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.2 t -69.6 -47.6 62.96 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.079 -177.236 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 10.0 pt-20 -67.26 -27.3 67.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.988 0.423 . . . . 0.0 110.618 177.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.23 -46.04 71.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.477 174.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -64.95 -33.88 77.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.903 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp . . . . . 0 C--N 1.311 -1.079 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.203 178.038 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 55.7 mttp . . . . . 0 N--CA 1.453 -0.321 0 CA-C-O 121.359 0.6 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -70.13 -26.91 64.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.433 0.635 . . . . 0.0 111.036 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.7 m -74.97 -30.67 61.26 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.907 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -65.98 -42.44 89.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.547 176.06 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.8 mt -62.42 -46.35 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -54.52 -44.37 72.7 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.454 -1.248 . . . . 0.0 110.695 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -68.91 -41.57 78.04 Favored 'General case' 0 C--O 1.216 -0.7 0 O-C-N 122.175 -0.328 . . . . 0.0 110.412 175.732 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.3 tt0 -57.11 -40.64 77.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 123.556 0.742 . . . . 0.0 111.807 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -60.44 -50.43 73.63 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 123.473 0.483 . . . . 0.0 110.195 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.75 -30.34 67.91 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.2 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 57.1 tt0 -55.74 -46.59 77.76 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.002 0.921 . . . . 0.0 110.146 177.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.0 t -83.29 -29.66 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.189 -178.373 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.0 ttt -61.72 -53.06 61.2 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.053 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.483 ' HG3' ' HA3' ' A' ' 18' ' ' GLY . 17.4 tppt? -148.3 94.28 4.25 Favored Pre-proline 0 N--CA 1.436 -1.169 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.664 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -72.86 122.05 7.84 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 122.61 2.206 . . . . 0.0 110.805 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 65.1 19.18 11.74 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 176.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.483 ' HA3' ' HG3' ' A' ' 15' ' ' LYS . . . -92.62 95.86 2.06 Favored Glycine 0 CA--C 1.491 -1.457 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 178.128 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -43.49 -51.59 6.53 Favored Glycine 0 C--O 1.22 -0.758 0 O-C-N 124.856 0.974 . . . . 0.0 115.394 -172.921 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 0.1 OUTLIER -69.07 -45.62 69.87 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 117.218 0.509 . . . . 0.0 112.073 -175.414 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -69.29 -42.14 75.86 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.753 0.787 . . . . 0.0 109.558 -175.991 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -69.76 -35.57 75.04 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.383 -1.281 . . . . 0.0 109.643 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.4 ttt180 -68.23 -39.82 82.21 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 177.227 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -62.57 -42.72 99.72 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.779 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.9 m -58.22 -45.26 88.01 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.463 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -53.98 -53.77 48.21 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -62.13 -51.08 69.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.112 -178.471 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -69.78 -42.71 73.43 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -176.025 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.8 t -63.77 -38.68 92.01 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.687 0.279 . . . . 0.0 110.491 -177.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -76.08 -33.87 59.53 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.526 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -68.14 -38.51 82.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.646 0.736 . . . . 0.0 109.459 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ARG . . . . . 0.437 ' HA ' ' NE ' ' A' ' 32' ' ' ARG . 4.6 tpm_? -67.32 -36.21 81.01 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.743 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.7 tp . . . . . 0 C--N 1.307 -1.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.129 -177.29 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 93.5 mttt . . . . . 0 N--CA 1.449 -0.519 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.63 -37.74 88.46 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.646 -179.222 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.84 -46.46 81.81 Favored 'General case' 0 C--N 1.282 -2.334 0 CA-C-N 113.847 -1.524 . . . . 0.0 109.135 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -64.03 -51.89 62.02 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.56 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 pt -62.91 -39.15 83.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.6 t -61.69 -32.98 73.21 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-O 120.943 0.402 . . . . 0.0 109.923 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 8' ' ' ARG . 8.8 tpt180 -71.56 -48.5 48.13 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 174.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -54.25 -43.84 71.28 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.639 0.587 . . . . 0.0 111.145 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -52.08 -49.02 64.36 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.838 0.711 . . . . 0.0 111.727 177.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.2 m -80.29 -23.83 40.43 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 178.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 -71.26 -32.72 69.06 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -82.0 -34.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.098 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.31 -55.14 35.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.828 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -146.45 87.46 6.48 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.8 120.28 7.29 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 121.827 1.685 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 63.97 32.54 13.0 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.336 0.654 . . . . 0.0 110.381 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.44 168.29 54.51 Favored Glycine 0 N--CA 1.437 -1.28 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.042 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.58 -92.32 2.11 Favored Glycine 0 N--CA 1.421 -2.311 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' GLU . . . . . 0.487 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.5 mp0 -51.28 -51.7 51.79 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 124.367 1.067 . . . . 0.0 110.846 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.17 -35.27 77.78 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.803 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -76.2 -36.0 58.82 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.391 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -61.76 -43.92 97.9 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -56.94 -51.2 70.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.767 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 m -55.49 -39.58 70.61 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.54 -54.01 50.57 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -61.17 -42.8 99.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.769 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.2 -43.81 81.2 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 177.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.1 t -67.38 -45.89 74.92 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.432 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -68.09 -27.89 66.87 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.097 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -75.73 -34.05 60.31 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.136 0.494 . . . . 0.0 110.09 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -76.28 -53.35 8.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.242 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 C--N 1.322 -0.614 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.748 -178.38 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.68 0 CA-C-O 121.455 0.645 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -73.96 -45.92 47.18 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.906 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.91 -29.62 66.84 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.147 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.0 m -61.58 -40.02 93.25 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.819 178.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -50.39 68.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.165 177.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 53.0 mt -58.18 -52.07 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-O 121.323 0.582 . . . . 0.0 109.977 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.2 t -52.17 -44.7 64.78 Favored 'General case' 0 C--O 1.248 0.99 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.89 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.2 -38.42 31.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.881 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.53 -30.28 71.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -176.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -57.56 -51.73 68.28 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.8 m -65.91 -30.18 70.72 Favored 'General case' 0 C--O 1.192 -1.949 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.893 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.47 -29.24 69.32 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.106 0.479 . . . . 0.0 110.197 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -87.08 -47.07 16.14 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.291 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.5 tpt -71.61 -42.01 68.22 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -136.35 83.84 30.8 Favored Pre-proline 0 C--N 1.312 -1.04 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.71 119.12 4.7 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.422 2.082 . . . . 0.0 112.583 -176.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 46.61 75.87 0.11 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.654 1.182 . . . . 0.0 113.292 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.82 -143.42 9.14 Favored Glycine 0 C--N 1.301 -1.375 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -128.89 -80.45 0.27 Allowed Glycine 0 C--N 1.297 -1.619 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -64.99 -28.39 69.48 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -56.11 -43.06 77.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.076 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -70.47 -44.91 66.77 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.555 -178.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -55.96 -53.65 54.37 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 124.016 0.823 . . . . 0.0 110.342 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 mtm180 -62.4 -51.55 67.11 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.728 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 m -57.28 -48.34 79.14 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.075 0.234 . . . . 0.0 111.009 -178.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.28 -51.2 67.07 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.528 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 1.2 tm-20 -61.89 -38.26 87.69 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 124.399 1.079 . . . . 0.0 109.657 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 39.1 t -65.23 -50.72 64.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.126 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.51 -28.93 69.99 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -65.48 -36.44 83.89 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.241 0.616 . . . . 0.0 110.068 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.6 mtt180 -81.16 -55.2 4.91 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.195 0.998 . . . . 0.0 109.769 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.5 tp -73.75 -47.43 39.2 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.745 -1.57 . . . . 0.0 113.707 -168.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 64.07 86.25 0.13 Allowed 'General case' 0 C--O 1.241 0.624 0 CA-C-O 122.032 0.92 . . . . 0.0 110.192 -172.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 C--N 1.304 -1.406 0 CA-C-N 114.84 -1.073 . . . . 0.0 108.409 -178.239 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.747 0 CA-C-O 121.377 0.608 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.472 ' O ' HG13 ' A' ' 6' ' ' ILE . 65.8 mttm -79.61 -13.16 59.71 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -177.359 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -71.39 -39.54 71.1 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.4 m -68.5 -34.18 75.44 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 113.278 -1.783 . . . . 0.0 109.077 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.51 -44.22 96.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.575 176.231 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 2' ' ' LYS . 86.5 mt -61.65 -54.94 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -48.02 -48.02 33.12 Favored 'General case' 0 C--O 1.256 1.422 0 C-N-CA 124.398 1.079 . . . . 0.0 112.093 176.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HD3' ' C ' ' A' ' 8' ' ' ARG . 1.1 tmt_? -66.96 -44.87 79.41 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 119.561 -0.257 . . . . 0.0 110.425 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -62.11 -30.8 71.27 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.353 0.597 . . . . 0.0 110.61 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -63.15 -55.67 23.28 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.355 172.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 m -64.4 -29.98 71.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -56.39 -46.84 79.93 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.039 0.936 . . . . 0.0 110.172 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 63.6 t -85.61 -48.14 16.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.123 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' MET . . . . . 0.46 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 15.3 tpt -64.92 -28.09 69.29 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -173.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -112.88 98.4 45.06 Favored Pre-proline 0 C--N 1.312 -1.065 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 14' ' ' MET . 60.6 Cg_endo -104.32 137.92 0.1 Allowed 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.417 2.744 . . . . 0.0 113.978 175.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 84.9 mt-30 70.89 -17.53 0.3 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 171.126 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.447 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -90.4 105.42 3.25 Favored Glycine 0 C--N 1.304 -1.205 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.245 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.94 -34.1 87.71 Favored Glycine 0 N--CA 1.464 0.523 0 C-N-CA 121.576 -0.345 . . . . 0.0 113.121 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 4.6 mp0 -63.52 -44.4 94.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.04 -40.24 95.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.647 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 14.8 mm100 -56.73 -56.55 19.99 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.929 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -66.57 -39.35 88.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.056 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -58.1 -53.11 61.95 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 m -55.17 -41.98 72.57 Favored 'General case' 0 CA--C 1.509 -0.626 0 O-C-N 124.144 0.903 . . . . 0.0 112.868 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.21 -49.01 73.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.977 0.418 . . . . 0.0 109.941 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -64.58 -42.35 95.67 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.982 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -76.4 -27.25 56.25 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.579 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.3 t -73.12 -33.63 65.66 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 30.9 mm-40 -63.22 -46.08 88.63 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 171.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -58.38 -38.31 77.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.663 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -67.42 -40.74 85.53 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 123.713 0.805 . . . . 0.0 111.178 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 64.4 tp -74.16 -43.97 55.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.889 -178.746 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 96.9 mtt180 -69.66 119.12 13.41 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.167 -176.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 CA--C 1.496 -1.113 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.351 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.276 0 CA-C-O 121.203 0.525 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -71.23 -28.08 63.94 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.174 0.511 . . . . 0.0 110.149 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 45.6 mt-10 -71.19 -25.73 62.65 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.01 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -76.83 -41.6 43.61 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.63 -53.28 59.95 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.397 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.3 pt -68.79 -35.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.45 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 17.5 t -57.72 -42.19 83.28 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 122.818 0.447 . . . . 0.0 110.194 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -80.56 -50.73 9.62 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.005 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.99 -39.51 71.97 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.409 0.443 . . . . 0.0 112.037 -174.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -58.04 -51.59 69.05 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 123.35 0.406 . . . . 0.0 110.066 -177.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.4 m -73.14 -34.81 66.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -61.2 -39.52 90.52 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.303 0.573 . . . . 0.0 110.575 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -82.41 -30.47 9.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.394 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 27.6 ttt -64.72 -55.2 21.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.346 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.415 ' HG3' ' OE2' ' A' ' 21' ' ' GLU . 13.9 mmmm -145.26 95.06 5.14 Favored Pre-proline 0 C--N 1.317 -0.845 0 C-N-CA 123.277 0.631 . . . . 0.0 109.558 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -74.39 123.09 7.94 Favored 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.526 2.151 . . . . 0.0 110.448 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 68.59 177.73 0.25 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.878 0.871 . . . . 0.0 111.872 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.25 -145.91 16.1 Favored Glycine 0 N--CA 1.432 -1.625 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -143.88 -73.89 0.03 OUTLIER Glycine 0 N--CA 1.437 -1.291 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.702 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.73 -43.41 93.49 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.07 0.462 . . . . 0.0 111.776 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE2' ' HG3' ' A' ' 15' ' ' LYS . 40.2 mt-10 -65.46 -27.7 68.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.209 0.528 . . . . 0.0 110.206 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -71.03 -39.05 72.56 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.358 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -64.89 -45.23 86.81 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 19.9 tpp180 -54.99 -57.32 12.18 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 123.996 0.81 . . . . 0.0 110.851 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 18.6 m -62.78 -31.85 72.9 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.09 -47.6 67.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.21 176.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.47 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 47.5 mm-40 -61.98 -49.52 75.75 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.098 177.571 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.6 t -66.7 -55.26 15.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.245 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.75 -32.65 74.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -173.849 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.31 -17.53 39.26 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.009 -1.077 . . . . 0.0 112.525 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -81.26 -40.58 23.52 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 62.7 tp -75.25 -36.53 61.26 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.905 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.401 ' HD2' ' HA ' ' A' ' 34' ' ' ARG . 23.0 mmm180 76.3 -75.32 0.07 Allowed 'General case' 0 CA--C 1.504 -0.792 0 C-N-CA 124.927 1.291 . . . . 0.0 112.634 -178.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.3 t70 . . . . . 0 C--N 1.29 -2.017 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 -179.58 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.517 0 CA-C-O 121.151 0.5 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -72.66 -49.63 30.43 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.451 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -65.14 -27.86 69.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.171 -178.137 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.8 m -72.24 -48.08 45.49 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.399 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.93 -48.9 79.71 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.45 -40.05 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.089 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 26.2 t -55.03 -47.82 74.22 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.6 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -80.02 -39.25 30.31 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.501 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.7 tt0 -58.74 -37.62 76.6 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.5 0.72 . . . . 0.0 111.799 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -60.02 -52.23 66.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.88 -28.66 65.83 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.885 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 46.6 tt0 -57.89 -47.3 83.18 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 124.023 0.929 . . . . 0.0 110.079 177.136 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.0 m -87.05 -25.1 6.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.877 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 50.1 tpp -75.96 -49.24 18.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.479 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -134.85 80.57 48.83 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -178.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -71.87 118.66 5.75 Favored 'Trans proline' 0 C--O 1.248 0.987 0 C-N-CA 121.749 1.633 . . . . 0.0 111.249 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 59.68 20.43 9.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.943 0.897 . . . . 0.0 112.702 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -87.26 75.51 2.15 Favored Glycine 0 C--O 1.217 -0.925 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -30.11 -54.83 0.22 Allowed Glycine 0 N--CA 1.479 1.535 0 C-N-CA 126.212 1.863 . . . . 0.0 117.093 -173.47 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.78 -55.81 26.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 117.87 0.835 . . . . 0.0 111.399 -177.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.68 -21.53 60.23 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.819 -177.32 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 30.1 tt0 -72.78 -41.73 64.69 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.616 176.233 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -70.93 -30.57 66.93 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 175.738 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 20.6 tpp180 -57.93 -50.24 74.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.695 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.6 m -58.67 -40.47 83.6 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.402 175.474 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 15.0 mm100 -59.37 -47.59 84.84 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.043 0.214 . . . . 0.0 110.472 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -60.34 -49.59 76.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.98 0.8 . . . . 0.0 110.276 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 44.2 mt-10 -64.33 -34.07 77.3 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.1 t -70.02 -41.48 74.24 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 46.6 mt-10 -63.21 -40.97 98.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -19.36 61.59 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.118 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -86.05 -50.42 7.05 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.088 0.471 . . . . 0.0 110.289 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.9 mt -71.49 -36.9 71.28 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.389 -175.679 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 70.0 mtt180 -90.65 146.29 24.15 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--N 1.287 -2.122 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 178.076 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.263 0 CA-C-O 121.003 0.43 . . . . 0.0 111.64 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -68.38 -26.12 65.41 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -175.608 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.55 -31.37 72.52 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.424 0.63 . . . . 0.0 110.237 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.3 m -79.08 -33.43 44.53 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.949 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -63.16 -51.6 65.78 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.33 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 69.2 mt -56.3 -46.31 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.2 t -54.2 -51.0 65.79 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 113.855 -1.521 . . . . 0.0 112.041 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -65.55 -43.0 91.24 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.528 -0.108 . . . . 0.0 110.773 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -61.25 -39.27 89.74 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -61.96 -54.39 42.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 123.575 0.547 . . . . 0.0 109.525 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 m -64.24 -29.91 70.98 Favored 'General case' 0 C--O 1.203 -1.395 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -66.06 -40.87 91.26 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 120.896 0.379 . . . . 0.0 110.765 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.8 p -89.06 -38.6 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 94.5 mmm -80.59 -25.33 38.55 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.17 96.13 49.82 Favored Pre-proline 0 C--N 1.309 -1.184 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -94.66 120.0 0.29 Allowed 'Trans proline' 0 N--CA 1.445 -1.377 0 C-N-CA 122.067 1.844 . . . . 0.0 111.989 176.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 68.28 -176.21 0.2 Allowed 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.908 0.883 . . . . 0.0 112.048 176.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.17 -41.68 2.16 Favored Glycine 0 C--N 1.297 -1.599 0 C-N-CA 121.208 -0.52 . . . . 0.0 111.805 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.63 -64.52 3.83 Favored Glycine 0 C--N 1.301 -1.405 0 C-N-CA 121.329 -0.462 . . . . 0.0 112.285 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.27 -40.24 81.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.053 0.541 . . . . 0.0 111.093 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.87 -36.17 82.42 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.649 0.738 . . . . 0.0 109.178 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -72.4 -41.2 66.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.698 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 29.0 tpt180 -56.34 -50.16 72.28 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.052 -0.977 . . . . 0.0 108.949 176.597 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -59.01 -42.24 89.65 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.304 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 m -54.3 -54.99 32.79 Favored 'General case' 0 C--O 1.215 -0.742 0 O-C-N 123.674 0.609 . . . . 0.0 112.021 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.78 -33.64 75.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 14.0 mm100 -62.12 -49.75 74.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -70.88 -29.62 65.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.518 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.2 t -63.79 -51.69 63.63 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.423 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.55 -25.31 62.16 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.66 -42.38 95.44 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -68.47 -37.93 80.59 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.925 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.55 -34.73 77.53 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.204 176.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 76.64 121.74 0.05 OUTLIER 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 125.578 1.551 . . . . 0.0 111.971 172.621 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 124.804 1.242 . . . . 0.0 109.664 -178.598 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.468 0 CA-C-O 120.785 0.326 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 6' ' ' ILE . 98.8 mttt -72.97 -42.18 63.6 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.32 -177.775 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -68.86 -32.74 72.62 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.9 m -64.88 -43.79 91.79 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.077 -1.42 . . . . 0.0 109.554 176.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.44 -43.76 93.29 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.274 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.4 mt -61.55 -50.39 80.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 t -51.52 -43.53 62.31 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.008 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -72.91 -46.48 52.4 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.222 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 56.9 tp60 -59.14 -41.89 89.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -174.311 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 78.6 t90 -55.5 -48.38 74.7 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.609 0.568 . . . . 0.0 110.327 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -77.65 -30.02 51.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.733 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -67.45 -41.39 84.79 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.963 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.1 p -84.02 -20.68 8.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-O 121.176 0.513 . . . . 0.0 110.01 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 22.4 ttt -60.95 -54.49 44.32 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -153.62 101.12 2.55 Favored Pre-proline 0 N--CA 1.428 -1.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.977 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.29 119.64 6.89 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.96 1.773 . . . . 0.0 108.978 173.678 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 59.53 74.6 0.44 Allowed 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 111.398 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -105.54 164.14 14.04 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.8 -92.15 2.07 Favored Glycine 0 N--CA 1.425 -2.06 0 C-N-CA 120.87 -0.681 . . . . 0.0 111.992 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.56 -46.87 83.94 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.452 0.701 . . . . 0.0 111.75 -174.491 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -65.36 -38.32 89.71 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 120.789 0.328 . . . . 0.0 111.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 26.3 tt0 -70.45 -32.9 70.65 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -64.2 -42.19 96.74 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -57.68 -48.17 80.26 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.485 174.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.3 m -55.74 -40.69 72.86 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.72 178.031 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.507 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 78.1 mt-30 -57.34 -51.22 70.29 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 123.349 0.405 . . . . 0.0 109.991 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.54 -49.56 73.0 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.052 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.34 -47.94 83.87 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.06 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 7.7 t -63.02 -42.75 99.88 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 122.941 0.15 . . . . 0.0 110.985 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 49.1 mt-10 -64.7 -39.96 94.55 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.953 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -87.15 -29.29 21.91 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.286 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -80.52 -44.46 19.07 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.104 0.478 . . . . 0.0 110.617 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 29' ' ' CYS . 45.1 tp -81.65 -48.36 11.81 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.219 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 73.1 mtp180 62.03 176.92 0.13 Allowed 'General case' 0 C--O 1.248 0.974 0 C-N-CA 124.159 0.984 . . . . 0.0 112.712 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.4 t70 . . . . . 0 C--N 1.299 -1.605 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 174.292 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.486 ' O ' ' HG2' ' A' ' 5' ' ' GLU . . . . . . . . 0 CA--C 1.514 -0.407 0 CA-C-O 120.776 0.322 . . . . 0.0 111.619 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -69.69 -39.17 77.1 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.582 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.25 -26.45 67.36 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.338 0.589 . . . . 0.0 110.699 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.1 m -70.48 -47.88 58.44 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.372 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 1' ' ' PCA . 16.0 mm-40 -62.67 -49.36 75.44 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.776 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.11 -53.33 44.64 Favored 'Isoleucine or valine' 0 C--O 1.245 0.833 0 CA-C-O 121.619 0.723 . . . . 0.0 109.662 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.25 -49.26 77.73 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.372 -1.285 . . . . 0.0 112.253 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -67.51 -41.56 84.25 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -56.57 -36.79 69.75 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 123.312 0.382 . . . . 0.0 110.614 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -59.66 -49.87 76.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.9 m -74.21 -27.34 60.74 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.924 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -69.62 -43.6 72.37 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.4 p -78.16 -20.46 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.338 0.589 . . . . 0.0 109.837 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 47.8 tpp -71.15 -49.38 44.55 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.688 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -151.88 107.88 2.86 Favored Pre-proline 0 N--CA 1.43 -1.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.311 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -57.58 139.78 91.3 Favored 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.704 2.269 . . . . 0.0 109.566 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 68.13 -67.21 0.2 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.683 1.193 . . . . 0.0 109.944 -172.059 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.484 ' HA3' ' HB2' ' A' ' 22' ' ' GLN . . . 87.71 -52.87 4.26 Favored Glycine 0 N--CA 1.436 -1.306 0 CA-C-N 116.578 -0.283 . . . . 0.0 112.919 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.39 -114.84 6.58 Favored Glycine 0 C--N 1.308 -1.009 0 N-CA-C 110.494 -1.043 . . . . 0.0 110.494 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -67.4 -29.04 68.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 117.153 0.477 . . . . 0.0 110.371 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.94 -31.37 66.27 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.158 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.484 ' HB2' ' HA3' ' A' ' 18' ' ' GLY . 4.4 tp-100 -76.17 -36.86 58.5 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.561 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 68.7 mtt180 -65.61 -39.36 91.45 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.298 176.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -64.42 -43.76 93.35 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.1 m -60.32 -39.52 87.34 Favored 'General case' 0 C--O 1.2 -1.503 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.403 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -58.22 -46.2 86.31 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.296 0.638 . . . . 0.0 109.973 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 23' ' ' ARG . 87.7 mt-30 -55.73 -52.87 62.42 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.802 0.689 . . . . 0.0 109.612 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -65.89 -39.6 90.79 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.357 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 t -65.42 -43.46 90.42 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 122.905 0.482 . . . . 0.0 110.263 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -62.85 -47.1 84.82 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.832 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.49 -38.32 86.87 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.456 0.702 . . . . 0.0 110.979 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -63.47 -45.42 90.89 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 123.813 0.845 . . . . 0.0 110.317 175.642 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.1 tp -69.65 -47.94 61.58 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.439 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -167.72 131.39 1.71 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.2 t70 . . . . . 0 C--N 1.3 -1.586 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.708 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.42 0 CA-C-O 121.082 0.467 . . . . 0.0 111.739 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 10.1 mtmp? -72.36 -38.57 68.53 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.747 0.784 . . . . 0.0 108.946 178.131 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLU . . . . . 0.591 ' CD ' ' H ' ' A' ' 3' ' ' GLU . 2.1 mp0 -54.25 -52.38 61.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 125.864 1.666 . . . . 0.0 109.574 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 p -72.85 -34.92 67.09 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 113.197 -1.819 . . . . 0.0 111.824 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.14 -52.27 66.44 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 122.593 0.357 . . . . 0.0 110.464 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 78.0 mt -60.88 -50.78 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.5 t -52.98 -47.0 68.51 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 114.131 -1.395 . . . . 0.0 111.18 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -61.92 -48.29 81.08 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 123.863 0.865 . . . . 0.0 110.529 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -61.72 -37.5 84.42 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.925 0.765 . . . . 0.0 111.686 -175.106 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -56.71 -53.04 62.31 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 121.477 0.656 . . . . 0.0 109.738 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.7 m -66.66 -37.61 85.14 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -64.79 -44.3 90.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.394 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.5 p -73.16 -29.86 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.156 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 17.2 tpt -69.42 -54.66 13.25 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.511 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -148.87 108.11 3.47 Favored Pre-proline 0 C--N 1.321 -0.672 0 C-N-CA 123.751 0.82 . . . . 0.0 109.604 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -66.5 119.45 6.48 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 121.82 1.68 . . . . 0.0 111.668 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 51.11 -95.43 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 126.177 1.791 . . . . 0.0 114.272 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.48 -115.24 5.55 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -161.88 -80.61 0.04 OUTLIER Glycine 0 N--CA 1.415 -2.712 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.0 -31.86 73.3 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -70.75 -41.07 72.28 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.66 -37.92 65.13 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.481 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.473 ' HD3' ' OE1' ' A' ' 26' ' ' GLN . 39.9 mmt180 -63.93 -41.04 97.74 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.078 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.445 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 51.0 ttp180 -63.68 -46.7 84.36 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.075 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 43.9 m -57.89 -34.48 69.84 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.473 ' OE1' ' HD3' ' A' ' 23' ' ' ARG . 54.6 mt-30 -60.64 -49.63 76.74 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.364 0.529 . . . . 0.0 110.355 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -62.41 -46.79 86.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.474 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 23.2 mm-40 -63.3 -46.91 84.53 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.191 0.596 . . . . 0.0 111.689 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 10.5 t -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 122.774 0.43 . . . . 0.0 111.0 -175.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.15 -25.09 61.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.604 -0.439 . . . . 0.0 110.656 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.31 -39.58 85.91 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 174.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.589 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 13.1 mmt180 -67.6 -38.08 83.49 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.55 176.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.9 tp -70.49 -25.45 63.16 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.729 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -82.98 -8.18 59.59 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.598 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.4 t70 . . . . . 0 C--N 1.307 -1.267 0 CA-C-O 118.797 -0.62 . . . . 0.0 110.51 -178.978 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.288 0 CA-C-O 121.299 0.571 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -63.64 -53.42 51.77 Favored 'General case' 0 C--O 1.252 1.2 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.448 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -79.05 -13.61 59.66 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.768 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.7 m -65.54 -45.17 84.42 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -59.25 -47.27 85.99 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.203 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.2 -54.88 26.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.072 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.3 t -54.98 -48.74 72.89 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.418 -1.264 . . . . 0.0 111.796 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -66.95 -46.96 73.12 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.118 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.411 ' O ' HG22 ' A' ' 13' ' ' VAL . 6.8 tp60 -57.46 -38.52 74.61 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.594 0.559 . . . . 0.0 110.584 -177.172 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -54.94 -54.93 36.44 Favored 'General case' 0 C--O 1.249 1.057 0 C-N-CA 123.666 0.786 . . . . 0.0 110.746 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.4 m -70.8 -36.22 72.9 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.075 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -61.33 -39.33 90.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.814 0.846 . . . . 0.0 111.547 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 9' ' ' GLN . 34.1 m -83.14 -30.87 8.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 61.0 mtm -77.83 -54.09 6.74 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 119.368 -0.933 . . . . 0.0 111.9 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -156.7 91.37 2.52 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.0 128.74 8.54 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.26 1.973 . . . . 0.0 113.036 -177.795 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 62.6 tt0 69.22 127.14 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.924 1.29 . . . . 0.0 113.678 175.531 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -177.56 164.17 33.11 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 109.234 -1.547 . . . . 0.0 109.234 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.33 -86.87 0.28 Allowed Glycine 0 N--CA 1.438 -1.222 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.351 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' A' ' 23' ' ' ARG . 5.9 tp10 -70.35 -33.12 71.09 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -178.708 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.11 -60.21 4.09 Favored 'General case' 0 C--O 1.245 0.859 0 C-N-CA 123.895 0.878 . . . . 0.0 110.922 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 56.2 tp60 -72.39 -23.83 61.16 Favored 'General case' 0 C--O 1.2 -1.549 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.019 -177.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.546 ' HD3' ' OE2' ' A' ' 20' ' ' GLU . 33.6 ttt180 -62.8 -33.96 76.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -63.09 -48.7 77.48 Favored 'General case' 0 CA--C 1.502 -0.878 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 175.433 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.9 m -58.75 -38.45 78.44 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.211 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 14.2 mm100 -61.38 -48.86 79.34 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 177.948 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 31' ' ' GLU . 76.9 mt-30 -63.4 -43.77 96.58 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.9 0.381 . . . . 0.0 111.586 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.648 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 6.8 mm-40 -67.48 -53.32 29.76 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.156 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.5 t -67.3 -51.95 46.37 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.192 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.82 -26.76 64.4 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -174.864 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -79.42 -27.51 41.76 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.016 176.699 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.648 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 34.3 mtm180 -81.44 -38.89 25.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.263 0.554 . . . . 0.0 110.206 178.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.4 mt -81.36 -28.03 34.63 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.857 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.6 ttp180 66.62 -87.49 0.03 OUTLIER 'General case' 0 C--O 1.244 0.798 0 C-N-CA 125.352 1.461 . . . . 0.0 110.019 -176.111 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 C--N 1.313 -1.0 0 C-N-CA 125.716 1.606 . . . . 0.0 107.395 -175.881 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.216 0 CA-C-O 120.653 0.263 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.426 ' O ' HG13 ' A' ' 6' ' ' ILE . 66.3 mttm -60.29 -50.34 74.04 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.517 -176.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.95 -41.12 82.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.447 0.641 . . . . 0.0 109.415 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.2 m -58.76 -42.83 89.8 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.253 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.38 -45.25 91.94 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.496 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 2' ' ' LYS . 58.6 mt -63.99 -50.48 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.908 0.861 . . . . 0.0 108.741 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.0 t -52.8 -45.91 67.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.864 -1.516 . . . . 0.0 112.414 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -30.81 51.65 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.526 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.511 ' O ' HG23 ' A' ' 13' ' ' VAL . 23.2 tp60 -60.2 -42.85 95.97 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 90.8 t90 -55.72 -43.84 76.91 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 123.649 0.78 . . . . 0.0 109.849 177.092 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.4 m -68.97 -36.71 78.2 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.65 -28.73 70.11 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 120.964 0.411 . . . . 0.0 111.334 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 9' ' ' GLN . 88.0 t -75.24 -38.97 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 121.446 0.641 . . . . 0.0 109.347 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.3 ttt -68.62 -54.66 15.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.737 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -156.46 101.59 2.04 Favored Pre-proline 0 C--N 1.307 -1.28 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -57.91 118.72 5.65 Favored 'Trans proline' 0 C--O 1.252 1.195 0 C-N-CA 122.406 2.071 . . . . 0.0 111.202 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 53.88 51.85 14.05 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.259 0.974 . . . . 0.0 110.405 -177.213 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.96 164.58 51.6 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.898 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.36 -95.92 0.3 Allowed Glycine 0 N--CA 1.432 -1.627 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -69.45 -26.21 64.48 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.648 -178.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -59.22 -56.88 16.54 Favored 'General case' 0 C--O 1.217 -0.606 0 O-C-N 123.546 0.529 . . . . 0.0 110.656 176.501 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -67.24 -29.73 69.44 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -176.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 25.5 mmm180 -63.98 -56.61 13.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.352 174.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -59.73 -40.79 89.23 Favored 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 123.414 0.447 . . . . 0.0 109.812 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.645 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 21.9 m -49.81 -56.95 8.44 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 124.243 0.964 . . . . 0.0 111.052 173.424 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -65.78 -33.93 77.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 15.6 mm100 -57.96 -51.01 71.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.261 0.351 . . . . 0.0 111.174 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.35 -29.45 42.23 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.979 0.418 . . . . 0.0 111.163 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.645 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.6 t -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.417 0.687 . . . . 0.0 109.21 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -74.07 -28.06 61.2 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.434 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 14.8 tp10 -61.4 -46.24 91.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.019 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -74.39 -33.3 63.0 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.515 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.6 tp -67.08 -47.85 69.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.441 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 49.0 ttt-85 -79.97 105.5 11.3 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.2 t70 . . . . . 0 C--N 1.299 -1.628 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.1 -174.607 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.463 0 CA-C-O 120.923 0.392 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -64.92 -45.77 84.47 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.656 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.98 -31.61 69.39 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.37 -178.833 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -64.47 -49.0 73.14 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.819 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.585 ' O ' ' HG3' ' A' ' 9' ' ' GLN . 8.3 tp10 -60.89 -48.97 79.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.215 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 82.6 mt -55.72 -52.91 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 CA-C-O 121.29 0.567 . . . . 0.0 109.667 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.9 t -52.39 -47.05 66.44 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.665 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -68.72 -35.72 77.51 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.614 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 5' ' ' GLU . 57.4 mt-30 -57.9 -37.67 74.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 118.158 0.435 . . . . 0.0 111.111 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.51 -50.62 73.09 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.057 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 m -82.04 -13.2 57.69 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -67.9 -34.18 76.14 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.7 t -79.6 -39.72 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.252 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.3 mmt -68.35 -55.23 12.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -136.6 87.04 21.59 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-O 120.871 0.367 . . . . 0.0 111.144 -176.219 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -88.49 120.15 1.2 Allowed 'Trans proline' 0 N--CA 1.443 -1.489 0 C-N-CA 122.643 2.229 . . . . 0.0 110.476 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 64.55 90.59 0.08 Allowed 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.872 1.269 . . . . 0.0 111.546 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.91 -173.17 20.68 Favored Glycine 0 N--CA 1.434 -1.447 0 C-N-CA 120.186 -1.006 . . . . 0.0 112.216 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.0 -96.25 2.24 Favored Glycine 0 N--CA 1.429 -1.801 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -63.34 -41.44 98.87 Favored 'General case' 0 C--O 1.207 -1.162 0 C-N-CA 122.979 0.512 . . . . 0.0 111.126 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -66.64 -32.56 73.95 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.265 0.555 . . . . 0.0 111.161 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -76.21 -37.93 57.13 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -64.58 -38.98 92.88 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.876 175.68 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -54.99 -52.22 63.77 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.573 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 m -64.97 -33.51 76.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.037 177.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.28 -48.85 63.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -61.03 -45.3 95.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.156 0.582 . . . . 0.0 109.607 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -53.23 -47.2 69.2 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.809 173.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.2 t -70.57 -41.01 72.98 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.277 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.472 ' HB3' ' NH1' ' A' ' 34' ' ' ARG . 48.5 mt-10 -60.7 -45.04 95.7 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.954 0.407 . . . . 0.0 110.52 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -68.57 -22.45 64.47 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.643 0.735 . . . . 0.0 110.941 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -87.88 -34.76 18.07 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.546 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.8 tp -76.44 -48.22 20.4 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.679 179.053 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' ARG . . . . . 0.472 ' NH1' ' HB3' ' A' ' 30' ' ' GLU . 61.1 mtt180 -73.95 -45.94 47.16 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.598 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 C--N 1.311 -1.068 0 O-C-N 124.97 1.419 . . . . 0.0 111.385 -179.807 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.592 0 CA-C-O 120.972 0.415 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -61.03 -37.75 83.71 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 124.069 0.948 . . . . 0.0 111.957 -176.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -61.24 -46.84 88.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.81 0.814 . . . . 0.0 110.398 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.0 m -74.51 -23.27 58.81 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.585 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.4 -51.01 61.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.772 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.27 -32.64 56.61 Favored 'Isoleucine or valine' 0 C--O 1.251 1.175 0 CA-C-O 121.492 0.663 . . . . 0.0 109.329 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.12 -48.17 82.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.797 175.218 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.2 ttt180 -64.86 -40.99 96.01 Favored 'General case' 0 C--O 1.213 -0.858 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 49.3 tt0 -50.33 -37.38 36.42 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.524 1.13 . . . . 0.0 111.706 -177.219 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.7 t90 -57.93 -49.18 77.63 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 121.744 0.783 . . . . 0.0 109.766 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.5 m -78.77 -31.06 45.96 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.195 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 59.6 tt0 -63.6 -43.9 95.56 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 123.786 0.835 . . . . 0.0 109.932 -178.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 p -78.14 -29.74 15.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.409 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.9 ttp -60.93 -55.1 36.99 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -157.12 108.05 1.9 Allowed Pre-proline 0 N--CA 1.439 -0.999 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.5 119.85 7.05 Favored 'Trans proline' 0 C--O 1.25 1.116 0 C-N-CA 122.121 1.881 . . . . 0.0 111.471 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 69.46 173.35 0.3 Allowed 'General case' 0 C--O 1.252 1.208 0 C-N-CA 124.51 1.124 . . . . 0.0 112.507 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 155.36 166.67 15.86 Favored Glycine 0 N--CA 1.421 -2.312 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 177.583 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.94 -87.79 1.06 Allowed Glycine 0 C--N 1.295 -1.731 0 C-N-CA 119.872 -1.156 . . . . 0.0 110.692 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 24' ' ' ARG . 39.0 mt-10 -67.96 -37.17 81.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.929 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.456 ' CD ' ' H ' ' A' ' 21' ' ' GLU . 1.8 mp0 -54.95 -42.18 72.0 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 123.648 0.592 . . . . 0.0 110.394 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -71.55 -38.62 70.98 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.727 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -68.09 -33.94 75.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.161 0.505 . . . . 0.0 109.966 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 91.8 mtt180 -65.48 -54.48 27.7 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.595 177.04 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.02 -37.27 74.01 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -59.01 -51.55 69.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 177.062 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -63.4 -46.73 85.06 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 32.7 mm-40 -55.22 -47.52 75.2 Favored 'General case' 0 C--O 1.217 -0.612 0 O-C-N 123.59 0.556 . . . . 0.0 110.645 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.7 t -59.45 -44.18 93.0 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.584 -178.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.12 -40.14 86.78 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.89 -30.58 61.34 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.5 mtt180 -73.2 -43.62 61.04 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.1 tp -64.39 -48.18 76.39 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.081 176.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 51.62 77.63 0.14 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.116 1.366 . . . . 0.0 111.489 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 C--N 1.288 -2.099 0 CA-C-N 113.494 -1.685 . . . . 0.0 107.929 -178.937 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.172 0 CA-C-O 120.784 0.326 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -65.02 -29.45 70.36 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -177.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -69.16 -30.08 68.24 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 121.641 0.734 . . . . 0.0 110.015 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.422 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 26.4 m -78.35 -32.95 49.32 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.234 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -63.1 -52.24 63.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.799 178.471 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.8 pt -66.17 -33.87 66.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.237 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 4' ' ' THR . 38.1 t -52.45 -47.58 66.35 Favored 'General case' 0 C--O 1.245 0.823 0 O-C-N 123.88 0.738 . . . . 0.0 111.041 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -78.39 -41.85 32.0 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.369 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -56.96 -41.25 78.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -59.02 -51.6 69.38 Favored 'General case' 0 N--CA 1.443 -0.779 0 O-C-N 123.757 0.661 . . . . 0.0 109.263 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.9 m -64.31 -39.58 94.19 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.369 178.62 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 61.1 tt0 -60.46 -45.4 93.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.057 0.456 . . . . 0.0 111.217 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 88.0 t -77.0 -45.86 30.0 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.401 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 16.3 tpt -70.02 -49.49 50.81 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.869 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.465 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 16.5 ptpt -130.56 79.7 71.63 Favored Pre-proline 0 C--N 1.308 -1.216 0 CA-C-O 121.734 0.778 . . . . 0.0 112.015 -175.111 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -82.94 120.66 3.06 Favored 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 122.87 2.38 . . . . 0.0 111.732 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 60.9 tt0 69.23 99.95 0.06 Allowed 'General case' 0 C--O 1.241 0.623 0 C-N-CA 124.989 1.316 . . . . 0.0 111.735 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -158.82 167.77 34.82 Favored Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 178.659 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.02 -90.95 1.63 Allowed Glycine 0 N--CA 1.431 -1.692 0 C-N-CA 120.382 -0.914 . . . . 0.0 111.384 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -64.42 -31.45 72.67 Favored 'General case' 0 C--O 1.214 -0.799 0 C-N-CA 122.33 0.252 . . . . 0.0 111.667 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 67.5 mm-40 -60.88 -50.81 71.93 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 120.809 0.338 . . . . 0.0 111.573 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -75.18 -32.86 61.37 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.967 0.413 . . . . 0.0 109.933 -178.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.03 -42.03 98.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.318 0.58 . . . . 0.0 109.595 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -63.35 -44.12 95.74 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.826 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 28.7 m -55.95 -47.12 78.18 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.454 0.471 . . . . 0.0 110.781 174.513 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -55.21 -56.67 17.32 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.52 0.513 . . . . 0.0 111.082 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -60.81 -46.72 89.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.356 -176.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -63.14 -41.44 99.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.208 0.527 . . . . 0.0 110.445 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.4 t -65.68 -45.35 83.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.09 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.66 -27.97 62.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.207 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -71.67 -36.39 70.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -70.28 -38.02 74.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.7 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.2 tp -58.13 -40.12 80.47 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.692 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 59.66 71.68 0.57 Allowed 'General case' 0 C--O 1.242 0.662 0 O-C-N 124.141 0.901 . . . . 0.0 110.75 179.011 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.1 t70 . . . . . 0 C--N 1.299 -1.59 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.609 -176.187 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.949 0 CA-C-O 120.933 0.397 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -62.24 -40.31 95.75 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -176.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.65 -30.62 70.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.345 0.593 . . . . 0.0 110.059 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.4 m -69.78 -36.55 75.83 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.561 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.59 -50.49 67.01 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.835 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.34 -50.42 80.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.932 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.9 t -50.47 -44.47 55.72 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.201 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -74.62 -48.82 24.25 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.975 177.731 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -54.7 -39.5 68.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.321 0.648 . . . . 0.0 111.99 -176.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 77.9 t90 -55.07 -52.97 61.52 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 123.78 0.675 . . . . 0.0 110.182 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -75.94 -32.21 59.45 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -56.63 -46.71 80.81 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.623 0.769 . . . . 0.0 110.602 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -86.01 -38.9 13.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.403 -177.125 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 15.1 tpt -62.23 -40.4 96.02 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.804 0.335 . . . . 0.0 111.624 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -127.3 108.84 21.31 Favored Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.075 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -54.91 158.59 10.85 Favored 'Trans proline' 0 C--O 1.25 1.101 0 C-N-CA 122.938 2.425 . . . . 0.0 111.261 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -63.81 112.51 2.92 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.505 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -128.67 -91.96 0.69 Allowed Glycine 0 N--CA 1.426 -1.968 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.03 -80.47 0.04 OUTLIER Glycine 0 C--N 1.302 -1.346 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.936 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -57.52 -39.65 77.02 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 123.061 0.545 . . . . 0.0 110.769 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 21' ' ' GLU . 1.3 mp0 -50.42 -54.95 18.13 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 124.632 1.173 . . . . 0.0 110.304 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -67.83 -37.98 82.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.531 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -61.24 -47.49 85.83 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -63.34 -46.67 85.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.004 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.2 m -62.25 -31.81 72.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -66.67 -43.75 83.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -64.59 -48.71 73.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.087 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 60.3 mm-40 -59.46 -43.72 93.13 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.958 177.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -59.6 -57.82 11.26 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.492 0.495 . . . . 0.0 110.74 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -57.7 -39.93 78.32 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.57 -43.31 97.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.647 -178.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 51.0 mtt180 -89.42 -28.69 19.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.656 -175.762 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.2 tp -71.7 -36.73 70.66 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.168 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -91.98 82.35 5.12 Favored 'General case' 0 N--CA 1.429 -1.524 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 C--N 1.292 -1.897 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.325 -177.965 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PCA . . . . . 0.485 ' O ' ' HG2' ' A' ' 5' ' ' GLU . . . . . . . . 0 CA--C 1.507 -0.681 0 CA-C-O 121.249 0.547 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -60.96 -45.78 93.35 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.111 -0.949 . . . . 0.0 111.261 -176.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.52 -31.45 72.18 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.975 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.0 m -72.07 -36.46 69.56 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 1' ' ' PCA . 16.8 mm-40 -67.69 -52.93 32.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.645 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.54 -38.07 81.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.3 t -58.74 -42.94 89.97 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.877 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 8' ' ' ARG . 8.6 tpt180 -75.71 -45.24 37.82 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.909 178.415 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.74 -31.83 72.84 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -59.85 -49.17 78.75 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 70.2 m -66.67 -43.57 84.14 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.762 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -59.29 -42.41 91.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.968 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.7 m -86.11 -19.64 8.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.35 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.2 ttt -75.08 -47.94 26.34 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.307 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -156.37 99.07 2.12 Favored Pre-proline 0 N--CA 1.438 -1.059 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.123 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -85.66 120.08 2.01 Favored 'Trans proline' 0 N--CA 1.451 -1.02 0 C-N-CA 122.609 2.206 . . . . 0.0 110.549 176.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 56.4 tp60 -164.59 -51.6 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.31 0.576 . . . . 0.0 110.635 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.47 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 105.49 -137.06 13.54 Favored Glycine 0 N--CA 1.416 -2.658 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 -174.859 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.551 ' O ' ' HG2' ' A' ' 23' ' ' ARG . . . 55.58 -135.99 47.65 Favored Glycine 0 C--O 1.246 0.898 0 O-C-N 123.934 0.432 . . . . 0.0 113.71 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.37 -30.11 63.07 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 122.693 0.397 . . . . 0.0 110.591 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -58.92 -43.85 91.19 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.954 0.883 . . . . 0.0 108.717 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.47 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 9.6 tt0 -69.96 -39.02 76.26 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.45 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 19' ' ' GLY . 30.9 mmm180 -61.8 -44.18 97.37 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 34.9 mmt180 -61.65 -49.67 75.6 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.529 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 24.6 m -62.13 -37.31 84.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 177.202 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -57.67 -52.98 63.2 Favored 'General case' 0 C--O 1.245 0.821 0 C-N-CA 122.935 0.494 . . . . 0.0 110.5 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -55.56 -58.86 6.05 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.486 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.8 pt-20 -66.68 -33.69 76.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.273 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 10.1 t -65.54 -52.53 51.74 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.365 0.126 . . . . 0.0 110.704 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -72.39 -25.93 61.69 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.38 -42.68 64.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -67.94 -37.76 82.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.119 177.744 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.5 tp -69.91 -33.65 72.46 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.766 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -69.35 106.39 2.9 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.36 0.6 . . . . 0.0 110.055 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 C--N 1.286 -2.189 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 179.175 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.198 0 CA-C-O 121.494 0.664 . . . . 0.0 110.452 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -68.59 -36.48 78.77 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.426 -175.792 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.73 -27.35 61.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 121.598 0.713 . . . . 0.0 110.974 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 m -74.7 -33.49 62.44 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.796 178.142 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -62.63 -47.74 82.4 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.04 176.949 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.7 -47.85 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.572 176.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.5 t -46.98 -46.58 21.73 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.944 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -70.22 -45.67 66.07 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.38 176.082 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -56.0 -35.15 66.48 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.288 0.367 . . . . 0.0 111.818 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -60.97 -55.41 33.29 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.071 0.462 . . . . 0.0 110.035 176.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.25 -32.56 72.84 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.518 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -57.28 -48.82 77.91 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 123.554 0.742 . . . . 0.0 110.631 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.7 t -79.53 -39.63 20.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.321 -0.854 . . . . 0.0 112.268 -176.498 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 60.0 mtt -84.0 -27.51 28.36 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -175.871 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.476 ' CG ' ' HB3' ' A' ' 21' ' ' GLU . 4.7 mptp? -108.91 107.35 59.96 Favored Pre-proline 0 C--N 1.308 -1.231 0 O-C-N 122.249 -0.282 . . . . 0.0 110.296 -177.241 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.56 121.19 8.68 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 123.507 2.805 . . . . 0.0 113.335 -178.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 68.3 -66.72 0.22 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.004 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.43 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 155.2 -120.95 1.05 Allowed Glycine 0 N--CA 1.424 -2.128 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.783 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.6 -143.98 26.25 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -56.2 -32.5 64.44 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.019 0.438 . . . . 0.0 111.214 177.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HB3' ' CG ' ' A' ' 15' ' ' LYS . 33.1 mm-40 -61.61 -40.69 95.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.672 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.43 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 36.1 tt0 -76.78 -34.45 58.0 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.594 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.71 -50.64 71.62 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.249 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.8 ttt180 -59.9 -45.76 91.49 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.158 177.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 31.5 m -59.27 -39.8 84.06 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 50.1 tt0 -62.29 -49.17 76.71 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.781 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.02 -52.48 63.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.766 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -68.21 -29.03 67.77 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.3 t -71.94 -43.56 65.05 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 58.8 mt-10 -68.79 -32.65 72.53 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.083 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.66 -38.34 83.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.657 0.741 . . . . 0.0 109.528 177.603 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -79.04 -34.05 44.18 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.961 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.9 tp -74.12 -32.01 63.01 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.286 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.6 ttp180 69.05 -77.08 0.05 Allowed 'General case' 0 C--O 1.237 0.44 0 C-N-CA 125.714 1.606 . . . . 0.0 111.313 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.1 t70 . . . . . 0 CA--C 1.488 -1.408 0 C-N-CA 125.346 1.459 . . . . 0.0 107.902 -174.501 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.468 0 CA-C-O 121.47 0.652 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.506 ' O ' HG13 ' A' ' 6' ' ' ILE . 67.0 mttm -69.38 -16.61 63.55 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -175.375 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.57 -40.2 80.66 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-O 121.635 0.731 . . . . 0.0 109.628 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 m -75.07 -32.6 61.54 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-N 114.383 -1.281 . . . . 0.0 108.886 178.493 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -58.94 -52.1 67.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.103 177.14 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.6 mt -57.93 -48.14 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.4 t -49.44 -53.8 20.97 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-N 114.148 -1.387 . . . . 0.0 111.916 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.05 -37.98 69.58 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.453 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -56.12 -41.21 74.92 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.866 0.466 . . . . 0.0 110.302 -179.261 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -60.76 -46.61 89.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.793 178.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.7 m -71.26 -30.61 66.51 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -64.91 -32.34 74.0 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.672 0.748 . . . . 0.0 109.929 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.4 t -85.71 -46.65 16.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.762 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.4 mmt -74.42 -39.29 62.71 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -176.567 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.471 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 64.7 mttm -131.3 74.61 78.78 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 122.872 0.469 . . . . 0.0 109.905 -177.437 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -87.58 120.18 1.44 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.688 2.259 . . . . 0.0 112.514 -176.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 63.82 -176.6 0.16 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.454 1.102 . . . . 0.0 111.655 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.65 -97.41 0.93 Allowed Glycine 0 C--N 1.29 -1.986 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . 0.489 ' O ' ' HG3' ' A' ' 23' ' ' ARG . . . 176.5 -91.6 0.08 OUTLIER Glycine 0 N--CA 1.426 -1.998 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.298 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.88 -45.09 70.96 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 -173.164 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 28.4 mm-40 -67.72 -35.57 79.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.048 0.451 . . . . 0.0 111.415 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.62 -38.93 70.74 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.158 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 19' ' ' GLY . 73.7 mtp180 -61.26 -42.79 99.23 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.966 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -61.83 -42.55 99.17 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.288 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.439 ' SG ' ' HD2' ' A' ' 15' ' ' LYS . 1.8 m -64.74 -34.92 79.45 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 34.8 tt0 -63.31 -50.6 69.4 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.398 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.12 -49.31 78.15 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.975 178.384 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -53.01 -49.44 66.22 Favored 'General case' 0 CA--C 1.498 -1.034 0 C-N-CA 123.891 0.876 . . . . 0.0 112.881 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 5.9 t -68.0 -34.48 76.6 Favored 'General case' 0 C--N 1.308 -1.225 0 O-C-N 123.55 0.531 . . . . 0.0 110.607 -175.676 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 12.2 mm-40 -68.85 -38.96 80.14 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.792 178.862 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -76.13 -18.76 59.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.989 0.423 . . . . 0.0 110.991 178.371 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -85.55 -54.58 4.47 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.199 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -85.67 -33.85 21.46 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.706 -178.26 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 60.42 93.73 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 176.145 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.8 t70 . . . . . 0 C--N 1.291 -1.946 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 176.02 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.373 0 CA-C-O 121.562 0.696 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 5' ' ' GLU . 74.0 mmtt -80.86 -32.27 35.08 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.901 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -78.48 -26.62 46.08 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.124 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.6 m -72.27 -32.34 66.55 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.397 175.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 2' ' ' LYS . 13.3 tp10 -62.06 -52.15 65.08 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.875 175.743 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 2' ' ' LYS . 61.2 mt -58.01 -50.41 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 121.396 0.617 . . . . 0.0 109.553 178.388 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.0 t -54.12 -48.17 71.04 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.346 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -69.92 -39.24 76.26 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.099 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -58.38 -38.62 77.67 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 178.018 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' TRP . . . . . 0.413 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 82.9 t90 -59.18 -55.06 39.76 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' SG ' ' HE3' ' A' ' 10' ' ' TRP . 96.4 m -67.41 -34.07 76.48 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -58.8 -45.88 88.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.031 0.443 . . . . 0.0 110.597 178.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.8 p -82.17 -35.16 12.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.178 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.52 -47.94 57.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.008 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -126.79 96.09 35.96 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.353 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -64.51 141.17 72.53 Favored 'Trans proline' 0 C--O 1.244 0.792 0 C-N-CA 122.157 1.905 . . . . 0.0 110.061 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 75.67 -53.44 0.63 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.417 1.487 . . . . 0.0 110.758 -176.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.6 -78.79 0.33 Allowed Glycine 0 N--CA 1.43 -1.766 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.213 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.05 -119.22 12.71 Favored Glycine 0 C--N 1.307 -1.083 0 N-CA-C 112.058 -0.417 . . . . 0.0 112.058 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -66.85 -34.13 77.12 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.79 0.805 . . . . 0.0 109.036 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.66 -18.53 60.52 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.646 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.439 HE22 ' NE2' ' A' ' 26' ' ' GLN . 18.7 tm0? -67.4 -45.53 75.88 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.201 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 23' ' ' ARG . 17.6 mmm180 -59.81 -48.98 79.51 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 124.152 0.908 . . . . 0.0 109.584 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ARG . . . . . 0.555 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 71.7 ttt180 -57.66 -56.87 16.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.482 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 10.7 m -57.36 -44.58 84.48 Favored 'General case' 0 C--O 1.204 -1.293 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.439 ' NE2' HE22 ' A' ' 22' ' ' GLN . 36.0 tt0 -63.47 -40.66 97.71 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -64.65 -44.65 89.77 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.564 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.0 mm-40 -71.77 -29.52 64.57 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.071 0.462 . . . . 0.0 110.066 179.316 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.2 t -69.6 -47.6 62.96 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.079 -177.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 10.0 pt-20 -67.26 -27.3 67.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.988 0.423 . . . . 0.0 110.618 177.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.23 -46.04 71.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.477 174.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -64.95 -33.88 77.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.903 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -70.88 -29.24 65.28 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.203 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -72.7 -57.2 4.29 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.392 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 . . . . . 0 C--N 1.299 -1.628 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.567 -179.435 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.476 0 CA-C-O 121.085 0.469 . . . . 0.0 111.63 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -67.63 -34.66 77.41 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.164 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -70.13 -26.91 64.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.433 0.635 . . . . 0.0 111.036 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.7 m -74.97 -30.67 61.26 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.907 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -65.98 -42.44 89.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.547 176.06 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.8 mt -62.42 -46.35 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -54.52 -44.37 72.7 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.454 -1.248 . . . . 0.0 110.695 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -68.91 -41.57 78.04 Favored 'General case' 0 C--O 1.216 -0.7 0 O-C-N 122.175 -0.328 . . . . 0.0 110.412 175.732 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.3 tt0 -57.11 -40.64 77.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 123.556 0.742 . . . . 0.0 111.807 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -60.44 -50.43 73.63 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 123.473 0.483 . . . . 0.0 110.195 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.75 -30.34 67.91 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.2 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 57.1 tt0 -55.74 -46.59 77.76 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.002 0.921 . . . . 0.0 110.146 177.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.0 t -83.29 -29.66 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.189 -178.373 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.0 ttt -61.72 -53.06 61.2 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.053 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.483 ' HG3' ' HA3' ' A' ' 18' ' ' GLY . 17.4 tppt? -148.3 94.28 4.25 Favored Pre-proline 0 N--CA 1.436 -1.169 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.664 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -72.86 122.05 7.84 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 122.61 2.206 . . . . 0.0 110.805 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 65.1 19.18 11.74 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 176.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.483 ' HA3' ' HG3' ' A' ' 15' ' ' LYS . . . -92.62 95.86 2.06 Favored Glycine 0 CA--C 1.491 -1.457 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 178.128 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -43.49 -51.59 6.53 Favored Glycine 0 C--O 1.22 -0.758 0 O-C-N 124.856 0.974 . . . . 0.0 115.394 -172.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 0.1 OUTLIER -69.07 -45.62 69.87 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 117.218 0.509 . . . . 0.0 112.073 -175.414 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -69.29 -42.14 75.86 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.753 0.787 . . . . 0.0 109.558 -175.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -69.76 -35.57 75.04 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.383 -1.281 . . . . 0.0 109.643 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.4 ttt180 -68.23 -39.82 82.21 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 177.227 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -62.57 -42.72 99.72 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.779 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.9 m -58.22 -45.26 88.01 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.463 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -53.98 -53.77 48.21 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -62.13 -51.08 69.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.112 -178.471 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -69.78 -42.71 73.43 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -176.025 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.8 t -63.77 -38.68 92.01 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.687 0.279 . . . . 0.0 110.491 -177.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -76.08 -33.87 59.53 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.526 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -68.14 -38.51 82.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.646 0.736 . . . . 0.0 109.459 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ARG . . . . . 0.437 ' HA ' ' NE ' ' A' ' 32' ' ' ARG . 4.6 tpm_? -67.32 -36.21 81.01 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.743 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.7 tp -75.37 -48.63 22.07 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.129 -177.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -101.17 114.75 29.0 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 120.997 0.427 . . . . 0.0 111.813 -173.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.2 t70 . . . . . 0 C--N 1.303 -1.449 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 175.59 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.308 0 CA-C-O 121.483 0.659 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -68.55 -49.57 58.5 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.016 -0.993 . . . . 0.0 109.698 -177.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.63 -37.74 88.46 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.646 -179.222 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.84 -46.46 81.81 Favored 'General case' 0 C--N 1.282 -2.334 0 CA-C-N 113.847 -1.524 . . . . 0.0 109.135 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -64.03 -51.89 62.02 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.56 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 pt -62.91 -39.15 83.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.6 t -61.69 -32.98 73.21 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-O 120.943 0.402 . . . . 0.0 109.923 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 8' ' ' ARG . 8.8 tpt180 -71.56 -48.5 48.13 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 174.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 94.5 mt-30 -54.25 -43.84 71.28 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.639 0.587 . . . . 0.0 111.145 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -52.08 -49.02 64.36 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.838 0.711 . . . . 0.0 111.727 177.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.2 m -80.29 -23.83 40.43 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 178.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 -71.26 -32.72 69.06 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -82.0 -34.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.098 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.31 -55.14 35.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.828 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -146.45 87.46 6.48 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.8 120.28 7.29 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 121.827 1.685 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 63.97 32.54 13.0 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.336 0.654 . . . . 0.0 110.381 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.44 168.29 54.51 Favored Glycine 0 N--CA 1.437 -1.28 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.042 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.58 -92.32 2.11 Favored Glycine 0 N--CA 1.421 -2.311 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' GLU . . . . . 0.487 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.5 mp0 -51.28 -51.7 51.79 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 124.367 1.067 . . . . 0.0 110.846 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.17 -35.27 77.78 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.803 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -76.2 -36.0 58.82 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.391 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -61.76 -43.92 97.9 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -56.94 -51.2 70.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.767 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 m -55.49 -39.58 70.61 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.54 -54.01 50.57 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -61.17 -42.8 99.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.769 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.2 -43.81 81.2 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 177.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.1 t -67.38 -45.89 74.92 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.432 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -68.09 -27.89 66.87 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.097 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -75.73 -34.05 60.31 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.136 0.494 . . . . 0.0 110.09 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -76.28 -53.35 8.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.242 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -78.41 -48.26 15.83 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.748 -178.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 56.54 82.25 0.12 Allowed 'General case' 0 C--O 1.238 0.484 0 CA-C-O 122.231 1.015 . . . . 0.0 112.316 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--N 1.298 -1.664 0 CA-C-N 114.167 -1.379 . . . . 0.0 108.991 -179.122 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp . . . . . 0 N--CA 1.439 -1.005 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.91 -29.62 66.84 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.147 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.0 m -61.58 -40.02 93.25 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.819 178.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -50.39 68.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.165 177.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 53.0 mt -58.18 -52.07 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-O 121.323 0.582 . . . . 0.0 109.977 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.2 t -52.17 -44.7 64.78 Favored 'General case' 0 C--O 1.248 0.99 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.89 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.2 -38.42 31.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.881 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.53 -30.28 71.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -176.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -57.56 -51.73 68.28 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.8 m -65.91 -30.18 70.72 Favored 'General case' 0 C--O 1.192 -1.949 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.893 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.47 -29.24 69.32 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.106 0.479 . . . . 0.0 110.197 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -87.08 -47.07 16.14 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.291 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.5 tpt -71.61 -42.01 68.22 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -136.35 83.84 30.8 Favored Pre-proline 0 C--N 1.312 -1.04 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.71 119.12 4.7 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.422 2.082 . . . . 0.0 112.583 -176.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 46.61 75.87 0.11 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.654 1.182 . . . . 0.0 113.292 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.82 -143.42 9.14 Favored Glycine 0 C--N 1.301 -1.375 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -128.89 -80.45 0.27 Allowed Glycine 0 C--N 1.297 -1.619 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -64.99 -28.39 69.48 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -56.11 -43.06 77.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.076 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -70.47 -44.91 66.77 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.555 -178.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -55.96 -53.65 54.37 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 124.016 0.823 . . . . 0.0 110.342 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 mtm180 -62.4 -51.55 67.11 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.728 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 m -57.28 -48.34 79.14 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.075 0.234 . . . . 0.0 111.009 -178.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.28 -51.2 67.07 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.528 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 1.2 tm-20 -61.89 -38.26 87.69 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 124.399 1.079 . . . . 0.0 109.657 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 39.1 t -65.23 -50.72 64.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.126 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.51 -28.93 69.99 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -65.48 -36.44 83.89 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.241 0.616 . . . . 0.0 110.068 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.6 mtt180 -81.16 -55.2 4.91 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.195 0.998 . . . . 0.0 109.769 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.5 tp . . . . . 0 C--N 1.307 -1.268 0 CA-C-N 113.745 -1.57 . . . . 0.0 113.707 -168.672 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.472 ' O ' HG13 ' A' ' 6' ' ' ILE . 65.8 mttm . . . . . 0 N--CA 1.425 -1.713 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -71.39 -39.54 71.1 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.4 m -68.5 -34.18 75.44 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 113.278 -1.783 . . . . 0.0 109.077 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.51 -44.22 96.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.575 176.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 2' ' ' LYS . 86.5 mt -61.65 -54.94 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -48.02 -48.02 33.12 Favored 'General case' 0 C--O 1.256 1.422 0 C-N-CA 124.398 1.079 . . . . 0.0 112.093 176.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HD3' ' C ' ' A' ' 8' ' ' ARG . 1.1 tmt_? -66.96 -44.87 79.41 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 119.561 -0.257 . . . . 0.0 110.425 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -62.11 -30.8 71.27 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.353 0.597 . . . . 0.0 110.61 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -63.15 -55.67 23.28 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.355 172.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 m -64.4 -29.98 71.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -56.39 -46.84 79.93 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.039 0.936 . . . . 0.0 110.172 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 63.6 t -85.61 -48.14 16.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.123 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . 0.46 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 15.3 tpt -64.92 -28.09 69.29 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -173.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -112.88 98.4 45.06 Favored Pre-proline 0 C--N 1.312 -1.065 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 14' ' ' MET . 60.6 Cg_endo -104.32 137.92 0.1 Allowed 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.417 2.744 . . . . 0.0 113.978 175.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 70.89 -17.53 0.3 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 171.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.447 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -90.4 105.42 3.25 Favored Glycine 0 C--N 1.304 -1.205 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.245 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.94 -34.1 87.71 Favored Glycine 0 N--CA 1.464 0.523 0 C-N-CA 121.576 -0.345 . . . . 0.0 113.121 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 4.6 mp0 -63.52 -44.4 94.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.04 -40.24 95.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.647 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 14.8 mm100 -56.73 -56.55 19.99 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.929 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -66.57 -39.35 88.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.056 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -58.1 -53.11 61.95 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 m -55.17 -41.98 72.57 Favored 'General case' 0 CA--C 1.509 -0.626 0 O-C-N 124.144 0.903 . . . . 0.0 112.868 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.21 -49.01 73.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.977 0.418 . . . . 0.0 109.941 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -64.58 -42.35 95.67 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.982 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -76.4 -27.25 56.25 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.579 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.3 t -73.12 -33.63 65.66 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 30.9 mm-40 -63.22 -46.08 88.63 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 171.993 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -58.38 -38.31 77.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.663 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -67.42 -40.74 85.53 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 123.713 0.805 . . . . 0.0 111.178 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 64.4 tp . . . . . 0 C--N 1.316 -0.888 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.889 -178.746 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 63.9 mttp . . . . . 0 N--CA 1.449 -0.492 0 CA-C-O 121.174 0.511 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 45.6 mt-10 -71.19 -25.73 62.65 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.01 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -76.83 -41.6 43.61 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.63 -53.28 59.95 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.397 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.3 pt -68.79 -35.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.45 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 17.5 t -57.72 -42.19 83.28 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 122.818 0.447 . . . . 0.0 110.194 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -80.56 -50.73 9.62 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.005 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.99 -39.51 71.97 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.409 0.443 . . . . 0.0 112.037 -174.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -58.04 -51.59 69.05 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 123.35 0.406 . . . . 0.0 110.066 -177.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.4 m -73.14 -34.81 66.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -61.2 -39.52 90.52 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.303 0.573 . . . . 0.0 110.575 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -82.41 -30.47 9.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.394 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 27.6 ttt -64.72 -55.2 21.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.346 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.415 ' HG3' ' OE2' ' A' ' 21' ' ' GLU . 13.9 mmmm -145.26 95.06 5.14 Favored Pre-proline 0 C--N 1.317 -0.845 0 C-N-CA 123.277 0.631 . . . . 0.0 109.558 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -74.39 123.09 7.94 Favored 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.526 2.151 . . . . 0.0 110.448 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 68.59 177.73 0.25 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.878 0.871 . . . . 0.0 111.872 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.25 -145.91 16.1 Favored Glycine 0 N--CA 1.432 -1.625 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -143.88 -73.89 0.03 OUTLIER Glycine 0 N--CA 1.437 -1.291 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.702 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.73 -43.41 93.49 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.07 0.462 . . . . 0.0 111.776 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE2' ' HG3' ' A' ' 15' ' ' LYS . 40.2 mt-10 -65.46 -27.7 68.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.209 0.528 . . . . 0.0 110.206 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -71.03 -39.05 72.56 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.358 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -64.89 -45.23 86.81 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 19.9 tpp180 -54.99 -57.32 12.18 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 123.996 0.81 . . . . 0.0 110.851 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 18.6 m -62.78 -31.85 72.9 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.09 -47.6 67.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.21 176.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.47 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 47.5 mm-40 -61.98 -49.52 75.75 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.098 177.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.6 t -66.7 -55.26 15.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.245 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.75 -32.65 74.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -173.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.31 -17.53 39.26 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.009 -1.077 . . . . 0.0 112.525 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -81.26 -40.58 23.52 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 62.7 tp . . . . . 0 C--N 1.314 -0.95 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.905 177.599 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt . . . . . 0 N--CA 1.445 -0.72 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -65.14 -27.86 69.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.171 -178.137 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.8 m -72.24 -48.08 45.49 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.399 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.93 -48.9 79.71 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.45 -40.05 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.089 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 26.2 t -55.03 -47.82 74.22 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.6 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -80.02 -39.25 30.31 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.501 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.7 tt0 -58.74 -37.62 76.6 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.5 0.72 . . . . 0.0 111.799 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -60.02 -52.23 66.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.88 -28.66 65.83 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.885 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 7.6 tt0 -57.89 -47.3 83.18 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 124.023 0.929 . . . . 0.0 110.079 177.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.0 m -87.05 -25.1 6.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.877 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 50.1 tpp -75.96 -49.24 18.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.479 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -134.85 80.57 48.83 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -178.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -71.87 118.66 5.75 Favored 'Trans proline' 0 C--O 1.248 0.987 0 C-N-CA 121.749 1.633 . . . . 0.0 111.249 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 59.68 20.43 9.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.943 0.897 . . . . 0.0 112.702 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -87.26 75.51 2.15 Favored Glycine 0 C--O 1.217 -0.925 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -30.11 -54.83 0.22 Allowed Glycine 0 N--CA 1.479 1.535 0 C-N-CA 126.212 1.863 . . . . 0.0 117.093 -173.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.78 -55.81 26.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 117.87 0.835 . . . . 0.0 111.399 -177.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.68 -21.53 60.23 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.819 -177.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 30.1 tt0 -72.78 -41.73 64.69 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.616 176.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -70.93 -30.57 66.93 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 175.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 20.6 tpp180 -57.93 -50.24 74.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.6 m -58.67 -40.47 83.6 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.402 175.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 15.0 mm100 -59.37 -47.59 84.84 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.043 0.214 . . . . 0.0 110.472 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -60.34 -49.59 76.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.98 0.8 . . . . 0.0 110.276 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 44.2 mt-10 -64.33 -34.07 77.3 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.1 t -70.02 -41.48 74.24 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 46.6 mt-10 -63.21 -40.97 98.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -19.36 61.59 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.118 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -86.05 -50.42 7.05 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.088 0.471 . . . . 0.0 110.289 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.9 mt . . . . . 0 C--N 1.318 -0.763 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.389 -175.679 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp . . . . . 0 N--CA 1.444 -0.729 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.55 -31.37 72.52 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.424 0.63 . . . . 0.0 110.237 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.3 m -79.08 -33.43 44.53 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.949 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -63.16 -51.6 65.78 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.33 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 69.2 mt -56.3 -46.31 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.2 t -54.2 -51.0 65.79 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 113.855 -1.521 . . . . 0.0 112.041 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -65.55 -43.0 91.24 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.528 -0.108 . . . . 0.0 110.773 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -61.25 -39.27 89.74 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -61.96 -54.39 42.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 123.575 0.547 . . . . 0.0 109.525 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 m -64.24 -29.91 70.98 Favored 'General case' 0 C--O 1.203 -1.395 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -66.06 -40.87 91.26 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 120.896 0.379 . . . . 0.0 110.765 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.8 p -89.06 -38.6 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 94.5 mmm -80.59 -25.33 38.55 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.17 96.13 49.82 Favored Pre-proline 0 C--N 1.309 -1.184 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -94.66 120.0 0.29 Allowed 'Trans proline' 0 N--CA 1.445 -1.377 0 C-N-CA 122.067 1.844 . . . . 0.0 111.989 176.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 68.28 -176.21 0.2 Allowed 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.908 0.883 . . . . 0.0 112.048 176.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.17 -41.68 2.16 Favored Glycine 0 C--N 1.297 -1.599 0 C-N-CA 121.208 -0.52 . . . . 0.0 111.805 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.63 -64.52 3.83 Favored Glycine 0 C--N 1.301 -1.405 0 C-N-CA 121.329 -0.462 . . . . 0.0 112.285 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.27 -40.24 81.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.053 0.541 . . . . 0.0 111.093 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.87 -36.17 82.42 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.649 0.738 . . . . 0.0 109.178 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -72.4 -41.2 66.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.698 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 29.0 tpt180 -56.34 -50.16 72.28 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.052 -0.977 . . . . 0.0 108.949 176.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -59.01 -42.24 89.65 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.304 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 m -54.3 -54.99 32.79 Favored 'General case' 0 C--O 1.215 -0.742 0 O-C-N 123.674 0.609 . . . . 0.0 112.021 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.78 -33.64 75.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 14.0 mm100 -62.12 -49.75 74.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -70.88 -29.62 65.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.518 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.2 t -63.79 -51.69 63.63 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.423 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.55 -25.31 62.16 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.66 -42.38 95.44 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -68.47 -37.93 80.59 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.925 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 53.5 tp . . . . . 0 C--O 1.24 0.584 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.204 176.49 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 6' ' ' ILE . 98.8 mttt . . . . . 0 N--CA 1.445 -0.702 0 CA-C-O 120.562 0.22 . . . . 0.0 111.32 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -68.86 -32.74 72.62 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.9 m -64.88 -43.79 91.79 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.077 -1.42 . . . . 0.0 109.554 176.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.44 -43.76 93.29 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.274 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.4 mt -61.55 -50.39 80.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 t -51.52 -43.53 62.31 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.008 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -72.91 -46.48 52.4 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.222 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -59.14 -41.89 89.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -174.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 78.6 t90 -55.5 -48.38 74.7 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.609 0.568 . . . . 0.0 110.327 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -77.65 -30.02 51.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.733 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -67.45 -41.39 84.79 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.963 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.1 p -84.02 -20.68 8.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-O 121.176 0.513 . . . . 0.0 110.01 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 22.4 ttt -60.95 -54.49 44.32 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -153.62 101.12 2.55 Favored Pre-proline 0 N--CA 1.428 -1.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.977 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.29 119.64 6.89 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.96 1.773 . . . . 0.0 108.978 173.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 59.53 74.6 0.44 Allowed 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 111.398 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -105.54 164.14 14.04 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.8 -92.15 2.07 Favored Glycine 0 N--CA 1.425 -2.06 0 C-N-CA 120.87 -0.681 . . . . 0.0 111.992 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.56 -46.87 83.94 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.452 0.701 . . . . 0.0 111.75 -174.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -65.36 -38.32 89.71 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 120.789 0.328 . . . . 0.0 111.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 26.3 tt0 -70.45 -32.9 70.65 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -64.2 -42.19 96.74 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -57.68 -48.17 80.26 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.485 174.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.3 m -55.74 -40.69 72.86 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.72 178.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.507 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 78.1 mt-30 -57.34 -51.22 70.29 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 123.349 0.405 . . . . 0.0 109.991 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.54 -49.56 73.0 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.052 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.34 -47.94 83.87 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.06 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 7.7 t -63.02 -42.75 99.88 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 122.941 0.15 . . . . 0.0 110.985 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 49.1 mt-10 -64.7 -39.96 94.55 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.953 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -87.15 -29.29 21.91 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.286 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -80.52 -44.46 19.07 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.104 0.478 . . . . 0.0 110.617 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 29' ' ' CYS . 45.1 tp . . . . . 0 C--N 1.307 -1.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.219 -179.44 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 86.5 tttt . . . . . 0 N--CA 1.443 -0.798 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.25 -26.45 67.36 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.338 0.589 . . . . 0.0 110.699 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.1 m -70.48 -47.88 58.44 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.372 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -62.67 -49.36 75.44 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.776 -177.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.11 -53.33 44.64 Favored 'Isoleucine or valine' 0 C--O 1.245 0.833 0 CA-C-O 121.619 0.723 . . . . 0.0 109.662 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.25 -49.26 77.73 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.372 -1.285 . . . . 0.0 112.253 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -67.51 -41.56 84.25 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -56.57 -36.79 69.75 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 123.312 0.382 . . . . 0.0 110.614 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -59.66 -49.87 76.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.9 m -74.21 -27.34 60.74 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.924 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -69.62 -43.6 72.37 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.4 p -78.16 -20.46 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.338 0.589 . . . . 0.0 109.837 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 47.8 tpp -71.15 -49.38 44.55 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.688 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -151.88 107.88 2.86 Favored Pre-proline 0 N--CA 1.43 -1.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.311 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -57.58 139.78 91.3 Favored 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.704 2.269 . . . . 0.0 109.566 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 68.13 -67.21 0.2 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.683 1.193 . . . . 0.0 109.944 -172.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.484 ' HA3' ' HB2' ' A' ' 22' ' ' GLN . . . 87.71 -52.87 4.26 Favored Glycine 0 N--CA 1.436 -1.306 0 CA-C-N 116.578 -0.283 . . . . 0.0 112.919 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.39 -114.84 6.58 Favored Glycine 0 C--N 1.308 -1.009 0 N-CA-C 110.494 -1.043 . . . . 0.0 110.494 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -67.4 -29.04 68.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 117.153 0.477 . . . . 0.0 110.371 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.94 -31.37 66.27 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.158 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.484 ' HB2' ' HA3' ' A' ' 18' ' ' GLY . 4.4 tp-100 -76.17 -36.86 58.5 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.561 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 68.7 mtt180 -65.61 -39.36 91.45 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.298 176.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -64.42 -43.76 93.35 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.1 m -60.32 -39.52 87.34 Favored 'General case' 0 C--O 1.2 -1.503 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.403 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -58.22 -46.2 86.31 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.296 0.638 . . . . 0.0 109.973 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 23' ' ' ARG . 18.8 mt-30 -55.73 -52.87 62.42 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.802 0.689 . . . . 0.0 109.612 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -65.89 -39.6 90.79 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.357 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 t -65.42 -43.46 90.42 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 122.905 0.482 . . . . 0.0 110.263 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -62.85 -47.1 84.82 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.832 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.49 -38.32 86.87 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.456 0.702 . . . . 0.0 110.979 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -63.47 -45.42 90.89 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 123.813 0.845 . . . . 0.0 110.317 175.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.1 tp . . . . . 0 C--N 1.315 -0.928 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.439 -177.454 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 10.1 mtmp? . . . . . 0 CA--C 1.515 -0.392 0 CA-C-O 121.747 0.784 . . . . 0.0 108.946 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . 0.591 ' H ' ' CD ' ' A' ' 3' ' ' GLU . 2.1 mp0 -54.25 -52.38 61.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 125.864 1.666 . . . . 0.0 109.574 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 p -72.85 -34.92 67.09 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 113.197 -1.819 . . . . 0.0 111.824 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.14 -52.27 66.44 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 122.593 0.357 . . . . 0.0 110.464 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 78.0 mt -60.88 -50.78 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.5 t -52.98 -47.0 68.51 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 114.131 -1.395 . . . . 0.0 111.18 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -61.92 -48.29 81.08 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 123.863 0.865 . . . . 0.0 110.529 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -61.72 -37.5 84.42 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.925 0.765 . . . . 0.0 111.686 -175.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -56.71 -53.04 62.31 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 121.477 0.656 . . . . 0.0 109.738 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.7 m -66.66 -37.61 85.14 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -64.79 -44.3 90.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.394 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.5 p -73.16 -29.86 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.156 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 17.2 tpt -69.42 -54.66 13.25 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.511 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -148.87 108.11 3.47 Favored Pre-proline 0 C--N 1.321 -0.672 0 C-N-CA 123.751 0.82 . . . . 0.0 109.604 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -66.5 119.45 6.48 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 121.82 1.68 . . . . 0.0 111.668 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 51.11 -95.43 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 126.177 1.791 . . . . 0.0 114.272 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.48 -115.24 5.55 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -161.88 -80.61 0.04 OUTLIER Glycine 0 N--CA 1.415 -2.712 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.0 -31.86 73.3 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -70.75 -41.07 72.28 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.66 -37.92 65.13 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.481 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.473 ' HD3' ' OE1' ' A' ' 26' ' ' GLN . 39.9 mmt180 -63.93 -41.04 97.74 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.445 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 51.0 ttp180 -63.68 -46.7 84.36 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 43.9 m -57.89 -34.48 69.84 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.473 ' OE1' ' HD3' ' A' ' 23' ' ' ARG . 54.6 mt-30 -60.64 -49.63 76.74 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.364 0.529 . . . . 0.0 110.355 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -62.41 -46.79 86.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.474 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 23.2 mm-40 -63.3 -46.91 84.53 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.191 0.596 . . . . 0.0 111.689 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 10.5 t -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 122.774 0.43 . . . . 0.0 111.0 -175.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.15 -25.09 61.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.604 -0.439 . . . . 0.0 110.656 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.31 -39.58 85.91 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 174.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.589 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 13.1 mmt180 -67.6 -38.08 83.49 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.55 176.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.9 tp . . . . . 0 C--N 1.309 -1.168 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.729 -179.807 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.3 mttt . . . . . 0 C--O 1.252 1.2 0 CA-C-O 120.954 0.407 . . . . 0.0 111.448 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -79.05 -13.61 59.66 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.768 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.7 m -65.54 -45.17 84.42 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -59.25 -47.27 85.99 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.203 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.2 -54.88 26.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.072 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.3 t -54.98 -48.74 72.89 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.418 -1.264 . . . . 0.0 111.796 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -66.95 -46.96 73.12 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.118 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.411 ' O ' HG22 ' A' ' 13' ' ' VAL . 6.8 tp60 -57.46 -38.52 74.61 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.594 0.559 . . . . 0.0 110.584 -177.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -54.94 -54.93 36.44 Favored 'General case' 0 C--O 1.249 1.057 0 C-N-CA 123.666 0.786 . . . . 0.0 110.746 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.4 m -70.8 -36.22 72.9 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.075 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -61.33 -39.33 90.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.814 0.846 . . . . 0.0 111.547 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 9' ' ' GLN . 34.1 m -83.14 -30.87 8.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 61.0 mtm -77.83 -54.09 6.74 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 119.368 -0.933 . . . . 0.0 111.9 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -156.7 91.37 2.52 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.0 128.74 8.54 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.26 1.973 . . . . 0.0 113.036 -177.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 69.22 127.14 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.924 1.29 . . . . 0.0 113.678 175.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -177.56 164.17 33.11 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 109.234 -1.547 . . . . 0.0 109.234 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.33 -86.87 0.28 Allowed Glycine 0 N--CA 1.438 -1.222 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.351 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' A' ' 23' ' ' ARG . 5.9 tp10 -70.35 -33.12 71.09 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -178.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.11 -60.21 4.09 Favored 'General case' 0 C--O 1.245 0.859 0 C-N-CA 123.895 0.878 . . . . 0.0 110.922 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 56.2 tp60 -72.39 -23.83 61.16 Favored 'General case' 0 C--O 1.2 -1.549 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.019 -177.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.546 ' HD3' ' OE2' ' A' ' 20' ' ' GLU . 33.6 ttt180 -62.8 -33.96 76.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -63.09 -48.7 77.48 Favored 'General case' 0 CA--C 1.502 -0.878 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 175.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.9 m -58.75 -38.45 78.44 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.211 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 14.2 mm100 -61.38 -48.86 79.34 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 177.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 31' ' ' GLU . 24.8 mt-30 -63.4 -43.77 96.58 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.9 0.381 . . . . 0.0 111.586 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.648 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 6.8 mm-40 -67.48 -53.32 29.76 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.156 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.5 t -67.3 -51.95 46.37 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.192 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.82 -26.76 64.4 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -174.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -79.42 -27.51 41.76 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.016 176.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.648 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 34.3 mtm180 -81.44 -38.89 25.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.263 0.554 . . . . 0.0 110.206 178.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.4 mt . . . . . 0 C--N 1.309 -1.182 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.857 179.55 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.426 ' O ' HG13 ' A' ' 6' ' ' ILE . 66.3 mttm . . . . . 0 CA--C 1.509 -0.616 0 N-CA-C 112.517 0.562 . . . . 0.0 112.517 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.95 -41.12 82.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.447 0.641 . . . . 0.0 109.415 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.2 m -58.76 -42.83 89.8 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.253 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.38 -45.25 91.94 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.496 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 2' ' ' LYS . 58.6 mt -63.99 -50.48 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.908 0.861 . . . . 0.0 108.741 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.0 t -52.8 -45.91 67.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.864 -1.516 . . . . 0.0 112.414 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -30.81 51.65 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.526 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.511 ' O ' HG23 ' A' ' 13' ' ' VAL . 23.2 tp60 -60.2 -42.85 95.97 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 90.8 t90 -55.72 -43.84 76.91 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 123.649 0.78 . . . . 0.0 109.849 177.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.4 m -68.97 -36.71 78.2 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.65 -28.73 70.11 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 120.964 0.411 . . . . 0.0 111.334 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 9' ' ' GLN . 88.0 t -75.24 -38.97 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 121.446 0.641 . . . . 0.0 109.347 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.3 ttt -68.62 -54.66 15.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.737 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -156.46 101.59 2.04 Favored Pre-proline 0 C--N 1.307 -1.28 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -57.91 118.72 5.65 Favored 'Trans proline' 0 C--O 1.252 1.195 0 C-N-CA 122.406 2.071 . . . . 0.0 111.202 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 53.88 51.85 14.05 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.259 0.974 . . . . 0.0 110.405 -177.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.96 164.58 51.6 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.898 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.36 -95.92 0.3 Allowed Glycine 0 N--CA 1.432 -1.627 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -69.45 -26.21 64.48 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.648 -178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -59.22 -56.88 16.54 Favored 'General case' 0 C--O 1.217 -0.606 0 O-C-N 123.546 0.529 . . . . 0.0 110.656 176.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -67.24 -29.73 69.44 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -176.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 25.5 mmm180 -63.98 -56.61 13.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.352 174.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -59.73 -40.79 89.23 Favored 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 123.414 0.447 . . . . 0.0 109.812 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.645 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 21.9 m -49.81 -56.95 8.44 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 124.243 0.964 . . . . 0.0 111.052 173.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -65.78 -33.93 77.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 15.6 mm100 -57.96 -51.01 71.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.261 0.351 . . . . 0.0 111.174 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.35 -29.45 42.23 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.979 0.418 . . . . 0.0 111.163 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.645 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.6 t -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.417 0.687 . . . . 0.0 109.21 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -74.07 -28.06 61.2 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.434 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 14.8 tp10 -61.4 -46.24 91.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.019 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -74.39 -33.3 63.0 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.515 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.6 tp . . . . . 0 C--N 1.323 -0.576 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.441 -179.208 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 57.1 tptt . . . . . 0 N--CA 1.439 -1.021 0 CA-C-O 120.882 0.373 . . . . 0.0 110.656 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.98 -31.61 69.39 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.37 -178.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -64.47 -49.0 73.14 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.819 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.585 ' O ' ' HG3' ' A' ' 9' ' ' GLN . 8.3 tp10 -60.89 -48.97 79.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.215 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 82.6 mt -55.72 -52.91 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 CA-C-O 121.29 0.567 . . . . 0.0 109.667 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.9 t -52.39 -47.05 66.44 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.665 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -68.72 -35.72 77.51 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.614 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 5' ' ' GLU . 57.4 mt-30 -57.9 -37.67 74.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 118.158 0.435 . . . . 0.0 111.111 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.51 -50.62 73.09 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.057 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 m -82.04 -13.2 57.69 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -67.9 -34.18 76.14 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.7 t -79.6 -39.72 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.252 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.3 mmt -68.35 -55.23 12.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -136.6 87.04 21.59 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-O 120.871 0.367 . . . . 0.0 111.144 -176.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -88.49 120.15 1.2 Allowed 'Trans proline' 0 N--CA 1.443 -1.489 0 C-N-CA 122.643 2.229 . . . . 0.0 110.476 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 64.55 90.59 0.08 Allowed 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.872 1.269 . . . . 0.0 111.546 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.91 -173.17 20.68 Favored Glycine 0 N--CA 1.434 -1.447 0 C-N-CA 120.186 -1.006 . . . . 0.0 112.216 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.0 -96.25 2.24 Favored Glycine 0 N--CA 1.429 -1.801 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -63.34 -41.44 98.87 Favored 'General case' 0 C--O 1.207 -1.162 0 C-N-CA 122.979 0.512 . . . . 0.0 111.126 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -66.64 -32.56 73.95 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.265 0.555 . . . . 0.0 111.161 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -76.21 -37.93 57.13 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -64.58 -38.98 92.88 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.876 175.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -54.99 -52.22 63.77 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 m -64.97 -33.51 76.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.037 177.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.28 -48.85 63.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -61.03 -45.3 95.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.156 0.582 . . . . 0.0 109.607 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -53.23 -47.2 69.2 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.809 173.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.2 t -70.57 -41.01 72.98 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.277 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -60.7 -45.04 95.7 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.954 0.407 . . . . 0.0 110.52 177.972 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -68.57 -22.45 64.47 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.643 0.735 . . . . 0.0 110.941 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -87.88 -34.76 18.07 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.546 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.8 tp . . . . . 0 C--N 1.31 -1.149 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.679 179.053 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 64.8 tttm . . . . . 0 N--CA 1.453 -0.316 0 N-CA-C 111.957 0.354 . . . . 0.0 111.957 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -61.24 -46.84 88.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.81 0.814 . . . . 0.0 110.398 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.0 m -74.51 -23.27 58.81 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.585 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.4 -51.01 61.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.772 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.27 -32.64 56.61 Favored 'Isoleucine or valine' 0 C--O 1.251 1.175 0 CA-C-O 121.492 0.663 . . . . 0.0 109.329 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.12 -48.17 82.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.797 175.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.2 ttt180 -64.86 -40.99 96.01 Favored 'General case' 0 C--O 1.213 -0.858 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.407 ' HA ' HE21 ' A' ' 12' ' ' GLN . 49.3 tt0 -50.33 -37.38 36.42 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.524 1.13 . . . . 0.0 111.706 -177.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.7 t90 -57.93 -49.18 77.63 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 121.744 0.783 . . . . 0.0 109.766 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.5 m -78.77 -31.06 45.96 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.195 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.407 HE21 ' HA ' ' A' ' 9' ' ' GLN . 9.4 tt0 -63.6 -43.9 95.56 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 123.786 0.835 . . . . 0.0 109.932 -178.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 p -78.14 -29.74 15.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.409 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.9 ttp -60.93 -55.1 36.99 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -157.12 108.05 1.9 Allowed Pre-proline 0 N--CA 1.439 -0.999 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.5 119.85 7.05 Favored 'Trans proline' 0 C--O 1.25 1.116 0 C-N-CA 122.121 1.881 . . . . 0.0 111.471 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 69.46 173.35 0.3 Allowed 'General case' 0 C--O 1.252 1.208 0 C-N-CA 124.51 1.124 . . . . 0.0 112.507 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 155.36 166.67 15.86 Favored Glycine 0 N--CA 1.421 -2.312 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 177.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.94 -87.79 1.06 Allowed Glycine 0 C--N 1.295 -1.731 0 C-N-CA 119.872 -1.156 . . . . 0.0 110.692 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 24' ' ' ARG . 39.0 mt-10 -67.96 -37.17 81.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.929 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.456 ' CD ' ' H ' ' A' ' 21' ' ' GLU . 1.8 mp0 -54.95 -42.18 72.0 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 123.648 0.592 . . . . 0.0 110.394 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -71.55 -38.62 70.98 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.727 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -68.09 -33.94 75.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.161 0.505 . . . . 0.0 109.966 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 91.8 mtt180 -65.48 -54.48 27.7 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.595 177.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.02 -37.27 74.01 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -59.01 -51.55 69.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 177.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -63.4 -46.73 85.06 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 32.7 mm-40 -55.22 -47.52 75.2 Favored 'General case' 0 C--O 1.217 -0.612 0 O-C-N 123.59 0.556 . . . . 0.0 110.645 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.7 t -59.45 -44.18 93.0 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.584 -178.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.12 -40.14 86.78 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.89 -30.58 61.34 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.5 mtt180 -73.2 -43.62 61.04 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.1 tp . . . . . 0 C--N 1.315 -0.929 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.081 176.053 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt . . . . . 0 N--CA 1.453 -0.285 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -69.16 -30.08 68.24 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 121.641 0.734 . . . . 0.0 110.015 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . 0.422 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 26.4 m -78.35 -32.95 49.32 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.234 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.51 ' HG2' ' NE2' ' A' ' 9' ' ' GLN . 36.2 tt0 -63.1 -52.24 63.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.799 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.8 pt -66.17 -33.87 66.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.237 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 4' ' ' THR . 38.1 t -52.45 -47.58 66.35 Favored 'General case' 0 C--O 1.245 0.823 0 O-C-N 123.88 0.738 . . . . 0.0 111.041 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -78.39 -41.85 32.0 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.369 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.51 ' NE2' ' HG2' ' A' ' 5' ' ' GLU . 49.6 mt-30 -56.96 -41.25 78.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.219 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -59.02 -51.6 69.38 Favored 'General case' 0 N--CA 1.443 -0.779 0 O-C-N 123.757 0.661 . . . . 0.0 109.263 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.9 m -64.31 -39.58 94.19 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.369 178.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.46 -45.4 93.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.057 0.456 . . . . 0.0 111.217 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 88.0 t -77.0 -45.86 30.0 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.401 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 16.3 tpt -70.02 -49.49 50.81 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.869 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.465 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 16.5 ptpt -130.56 79.7 71.63 Favored Pre-proline 0 C--N 1.308 -1.216 0 CA-C-O 121.734 0.778 . . . . 0.0 112.015 -175.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -82.94 120.66 3.06 Favored 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 122.87 2.38 . . . . 0.0 111.732 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 69.23 99.95 0.06 Allowed 'General case' 0 C--O 1.241 0.623 0 C-N-CA 124.989 1.316 . . . . 0.0 111.735 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -158.82 167.77 34.82 Favored Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 178.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.02 -90.95 1.63 Allowed Glycine 0 N--CA 1.431 -1.692 0 C-N-CA 120.382 -0.914 . . . . 0.0 111.384 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -64.42 -31.45 72.67 Favored 'General case' 0 C--O 1.214 -0.799 0 C-N-CA 122.33 0.252 . . . . 0.0 111.667 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 67.5 mm-40 -60.88 -50.81 71.93 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 120.809 0.338 . . . . 0.0 111.573 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -75.18 -32.86 61.37 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.967 0.413 . . . . 0.0 109.933 -178.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.03 -42.03 98.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.318 0.58 . . . . 0.0 109.595 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -63.35 -44.12 95.74 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.826 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 28.7 m -55.95 -47.12 78.18 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.454 0.471 . . . . 0.0 110.781 174.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -55.21 -56.67 17.32 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.52 0.513 . . . . 0.0 111.082 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -60.81 -46.72 89.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.356 -176.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -63.14 -41.44 99.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.208 0.527 . . . . 0.0 110.445 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.4 t -65.68 -45.35 83.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.09 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.66 -27.97 62.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.207 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -71.67 -36.39 70.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -70.28 -38.02 74.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.7 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.2 tp . . . . . 0 C--O 1.244 0.809 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.692 179.585 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.9 mttt . . . . . 0 CA--C 1.506 -0.736 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.65 -30.62 70.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.345 0.593 . . . . 0.0 110.059 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.4 m -69.78 -36.55 75.83 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.561 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.59 -50.49 67.01 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.835 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.34 -50.42 80.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.932 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.9 t -50.47 -44.47 55.72 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.201 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -74.62 -48.82 24.25 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.975 177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -54.7 -39.5 68.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.321 0.648 . . . . 0.0 111.99 -176.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 77.9 t90 -55.07 -52.97 61.52 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 123.78 0.675 . . . . 0.0 110.182 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -75.94 -32.21 59.45 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -56.63 -46.71 80.81 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.623 0.769 . . . . 0.0 110.602 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -86.01 -38.9 13.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.403 -177.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 15.1 tpt -62.23 -40.4 96.02 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.804 0.335 . . . . 0.0 111.624 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -127.3 108.84 21.31 Favored Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.075 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -54.91 158.59 10.85 Favored 'Trans proline' 0 C--O 1.25 1.101 0 C-N-CA 122.938 2.425 . . . . 0.0 111.261 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -63.81 112.51 2.92 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.505 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -128.67 -91.96 0.69 Allowed Glycine 0 N--CA 1.426 -1.968 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.03 -80.47 0.04 OUTLIER Glycine 0 C--N 1.302 -1.346 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.936 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -57.52 -39.65 77.02 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 123.061 0.545 . . . . 0.0 110.769 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 21' ' ' GLU . 1.3 mp0 -50.42 -54.95 18.13 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 124.632 1.173 . . . . 0.0 110.304 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -67.83 -37.98 82.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.531 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -61.24 -47.49 85.83 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -63.34 -46.67 85.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.004 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.2 m -62.25 -31.81 72.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -66.67 -43.75 83.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -64.59 -48.71 73.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.087 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 60.3 mm-40 -59.46 -43.72 93.13 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.958 177.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -59.6 -57.82 11.26 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.492 0.495 . . . . 0.0 110.74 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -57.7 -39.93 78.32 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.57 -43.31 97.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.647 -178.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 51.0 mtt180 -89.42 -28.69 19.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.656 -175.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.2 tp . . . . . 0 C--N 1.308 -1.22 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.168 -179.779 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm . . . . . 0 CA--C 1.508 -0.648 0 CA-C-O 120.631 0.253 . . . . 0.0 111.261 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.52 -31.45 72.18 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.975 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.0 m -72.07 -36.46 69.56 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -67.69 -52.93 32.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.645 179.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.54 -38.07 81.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.3 t -58.74 -42.94 89.97 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.877 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 8' ' ' ARG . 8.6 tpt180 -75.71 -45.24 37.82 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.909 178.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.74 -31.83 72.84 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -59.85 -49.17 78.75 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 70.2 m -66.67 -43.57 84.14 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.762 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -59.29 -42.41 91.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.968 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.7 m -86.11 -19.64 8.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.35 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.2 ttt -75.08 -47.94 26.34 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.307 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -156.37 99.07 2.12 Favored Pre-proline 0 N--CA 1.438 -1.059 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.123 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -85.66 120.08 2.01 Favored 'Trans proline' 0 N--CA 1.451 -1.02 0 C-N-CA 122.609 2.206 . . . . 0.0 110.549 176.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -164.59 -51.6 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.31 0.576 . . . . 0.0 110.635 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.47 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 105.49 -137.06 13.54 Favored Glycine 0 N--CA 1.416 -2.658 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 -174.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.551 ' O ' ' HG2' ' A' ' 23' ' ' ARG . . . 55.58 -135.99 47.65 Favored Glycine 0 C--O 1.246 0.898 0 O-C-N 123.934 0.432 . . . . 0.0 113.71 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.37 -30.11 63.07 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 122.693 0.397 . . . . 0.0 110.591 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -58.92 -43.85 91.19 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.954 0.883 . . . . 0.0 108.717 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.47 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 9.6 tt0 -69.96 -39.02 76.26 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.45 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 19' ' ' GLY . 30.9 mmm180 -61.8 -44.18 97.37 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 34.9 mmt180 -61.65 -49.67 75.6 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.529 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 24.6 m -62.13 -37.31 84.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 177.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -57.67 -52.98 63.2 Favored 'General case' 0 C--O 1.245 0.821 0 C-N-CA 122.935 0.494 . . . . 0.0 110.5 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -55.56 -58.86 6.05 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.486 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.8 pt-20 -66.68 -33.69 76.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.273 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 10.1 t -65.54 -52.53 51.74 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.365 0.126 . . . . 0.0 110.704 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -72.39 -25.93 61.69 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.38 -42.68 64.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -67.94 -37.76 82.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.119 177.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.5 tp . . . . . 0 C--N 1.31 -1.148 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.766 179.964 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt . . . . . 0 N--CA 1.446 -0.631 0 CA-C-O 120.749 0.309 . . . . 0.0 111.426 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.73 -27.35 61.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 121.598 0.713 . . . . 0.0 110.974 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 m -74.7 -33.49 62.44 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.796 178.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -62.63 -47.74 82.4 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.04 176.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.7 -47.85 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.572 176.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.5 t -46.98 -46.58 21.73 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.944 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -70.22 -45.67 66.07 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.38 176.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -56.0 -35.15 66.48 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.288 0.367 . . . . 0.0 111.818 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -60.97 -55.41 33.29 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.071 0.462 . . . . 0.0 110.035 176.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.25 -32.56 72.84 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.518 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -57.28 -48.82 77.91 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 123.554 0.742 . . . . 0.0 110.631 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.7 t -79.53 -39.63 20.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.321 -0.854 . . . . 0.0 112.268 -176.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 60.0 mtt -84.0 -27.51 28.36 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -175.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.476 ' CG ' ' HB3' ' A' ' 21' ' ' GLU . 4.7 mptp? -108.91 107.35 59.96 Favored Pre-proline 0 C--N 1.308 -1.231 0 O-C-N 122.249 -0.282 . . . . 0.0 110.296 -177.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.56 121.19 8.68 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 123.507 2.805 . . . . 0.0 113.335 -178.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 68.3 -66.72 0.22 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.004 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.43 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 155.2 -120.95 1.05 Allowed Glycine 0 N--CA 1.424 -2.128 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.783 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.6 -143.98 26.25 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -56.2 -32.5 64.44 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.019 0.438 . . . . 0.0 111.214 177.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HB3' ' CG ' ' A' ' 15' ' ' LYS . 33.1 mm-40 -61.61 -40.69 95.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.672 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.43 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 36.1 tt0 -76.78 -34.45 58.0 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.594 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.71 -50.64 71.62 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.249 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.8 ttt180 -59.9 -45.76 91.49 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.158 177.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 31.5 m -59.27 -39.8 84.06 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 50.1 tt0 -62.29 -49.17 76.71 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.02 -52.48 63.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.766 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -68.21 -29.03 67.77 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.3 t -71.94 -43.56 65.05 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 58.8 mt-10 -68.79 -32.65 72.53 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.66 -38.34 83.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.657 0.741 . . . . 0.0 109.528 177.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -79.04 -34.05 44.18 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.961 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.9 tp . . . . . 0 C--N 1.311 -1.102 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.286 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.506 ' O ' HG13 ' A' ' 6' ' ' ILE . 67.0 mttm . . . . . 0 N--CA 1.431 -1.409 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.57 -40.2 80.66 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-O 121.635 0.731 . . . . 0.0 109.628 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 m -75.07 -32.6 61.54 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-N 114.383 -1.281 . . . . 0.0 108.886 178.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -58.94 -52.1 67.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.103 177.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.6 mt -57.93 -48.14 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.4 t -49.44 -53.8 20.97 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-N 114.148 -1.387 . . . . 0.0 111.916 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.05 -37.98 69.58 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.453 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -56.12 -41.21 74.92 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.866 0.466 . . . . 0.0 110.302 -179.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -60.76 -46.61 89.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.793 178.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.7 m -71.26 -30.61 66.51 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -64.91 -32.34 74.0 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.672 0.748 . . . . 0.0 109.929 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.4 t -85.71 -46.65 16.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.762 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.4 mmt -74.42 -39.29 62.71 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -176.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.471 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 64.7 mttm -131.3 74.61 78.78 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 122.872 0.469 . . . . 0.0 109.905 -177.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -87.58 120.18 1.44 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.688 2.259 . . . . 0.0 112.514 -176.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 63.82 -176.6 0.16 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.454 1.102 . . . . 0.0 111.655 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.65 -97.41 0.93 Allowed Glycine 0 C--N 1.29 -1.986 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . 0.489 ' O ' ' HG3' ' A' ' 23' ' ' ARG . . . 176.5 -91.6 0.08 OUTLIER Glycine 0 N--CA 1.426 -1.998 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.298 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.88 -45.09 70.96 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 -173.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 28.4 mm-40 -67.72 -35.57 79.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.048 0.451 . . . . 0.0 111.415 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.62 -38.93 70.74 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.158 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 19' ' ' GLY . 73.7 mtp180 -61.26 -42.79 99.23 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.966 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -61.83 -42.55 99.17 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.288 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.439 ' SG ' ' HD2' ' A' ' 15' ' ' LYS . 1.8 m -64.74 -34.92 79.45 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 34.8 tt0 -63.31 -50.6 69.4 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.12 -49.31 78.15 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.975 178.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -53.01 -49.44 66.22 Favored 'General case' 0 CA--C 1.498 -1.034 0 C-N-CA 123.891 0.876 . . . . 0.0 112.881 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 5.9 t -68.0 -34.48 76.6 Favored 'General case' 0 C--N 1.308 -1.225 0 O-C-N 123.55 0.531 . . . . 0.0 110.607 -175.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 12.2 mm-40 -68.85 -38.96 80.14 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.792 178.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -76.13 -18.76 59.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.989 0.423 . . . . 0.0 110.991 178.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -85.55 -54.58 4.47 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.199 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? . . . . . 0 C--N 1.317 -0.841 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.706 -178.26 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 5' ' ' GLU . 74.0 mmtt . . . . . 0 N--CA 1.44 -0.93 0 N-CA-C 111.901 0.334 . . . . 0.0 111.901 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -78.48 -26.62 46.08 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.124 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.6 m -72.27 -32.34 66.55 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.397 175.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 2' ' ' LYS . 13.3 tp10 -62.06 -52.15 65.08 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.875 175.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 2' ' ' LYS . 61.2 mt -58.01 -50.41 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 121.396 0.617 . . . . 0.0 109.553 178.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.0 t -54.12 -48.17 71.04 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.346 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -69.92 -39.24 76.26 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.099 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -58.38 -38.62 77.67 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 178.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . 0.413 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 82.9 t90 -59.18 -55.06 39.76 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . 0.413 ' SG ' ' HE3' ' A' ' 10' ' ' TRP . 96.4 m -67.41 -34.07 76.48 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -58.8 -45.88 88.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.031 0.443 . . . . 0.0 110.597 178.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.8 p -82.17 -35.16 12.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.178 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.52 -47.94 57.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.008 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -126.79 96.09 35.96 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.353 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -64.51 141.17 72.53 Favored 'Trans proline' 0 C--O 1.244 0.792 0 C-N-CA 122.157 1.905 . . . . 0.0 110.061 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 75.67 -53.44 0.63 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.417 1.487 . . . . 0.0 110.758 -176.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.6 -78.79 0.33 Allowed Glycine 0 N--CA 1.43 -1.766 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.213 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.05 -119.22 12.71 Favored Glycine 0 C--N 1.307 -1.083 0 N-CA-C 112.058 -0.417 . . . . 0.0 112.058 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -66.85 -34.13 77.12 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.79 0.805 . . . . 0.0 109.036 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.66 -18.53 60.52 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.646 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.439 HE22 ' NE2' ' A' ' 26' ' ' GLN . 18.7 tm0? -67.4 -45.53 75.88 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 23' ' ' ARG . 17.6 mmm180 -59.81 -48.98 79.51 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 124.152 0.908 . . . . 0.0 109.584 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . 0.555 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 71.7 ttt180 -57.66 -56.87 16.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.482 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 10.7 m -57.36 -44.58 84.48 Favored 'General case' 0 C--O 1.204 -1.293 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.439 ' NE2' HE22 ' A' ' 22' ' ' GLN . 36.0 tt0 -63.47 -40.66 97.71 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -64.65 -44.65 89.77 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.564 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.0 mm-40 -71.77 -29.52 64.57 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.071 0.462 . . . . 0.0 110.066 179.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.2 t -69.6 -47.6 62.96 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.079 -177.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 10.0 pt-20 -67.26 -27.3 67.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.988 0.423 . . . . 0.0 110.618 177.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.23 -46.04 71.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.477 174.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -64.95 -33.88 77.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.903 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp . . . . . 0 C--N 1.311 -1.079 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.203 178.038 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 55.7 mttp . . . . . 0 N--CA 1.453 -0.321 0 CA-C-O 121.359 0.6 . . . . 0.0 110.164 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -70.13 -26.91 64.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.433 0.635 . . . . 0.0 111.036 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.7 m -74.97 -30.67 61.26 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.907 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -65.98 -42.44 89.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.547 176.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.8 mt -62.42 -46.35 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -54.52 -44.37 72.7 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.454 -1.248 . . . . 0.0 110.695 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -68.91 -41.57 78.04 Favored 'General case' 0 C--O 1.216 -0.7 0 O-C-N 122.175 -0.328 . . . . 0.0 110.412 175.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.3 tt0 -57.11 -40.64 77.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 123.556 0.742 . . . . 0.0 111.807 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -60.44 -50.43 73.63 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 123.473 0.483 . . . . 0.0 110.195 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.75 -30.34 67.91 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.2 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 8.3 tt0 -55.74 -46.59 77.76 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.002 0.921 . . . . 0.0 110.146 177.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.0 t -83.29 -29.66 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.189 -178.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.0 ttt -61.72 -53.06 61.2 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.053 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.483 ' HG3' ' HA3' ' A' ' 18' ' ' GLY . 17.4 tppt? -148.3 94.28 4.25 Favored Pre-proline 0 N--CA 1.436 -1.169 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.664 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -72.86 122.05 7.84 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 122.61 2.206 . . . . 0.0 110.805 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 65.1 19.18 11.74 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 176.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.483 ' HA3' ' HG3' ' A' ' 15' ' ' LYS . . . -92.62 95.86 2.06 Favored Glycine 0 CA--C 1.491 -1.457 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 178.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -43.49 -51.59 6.53 Favored Glycine 0 C--O 1.22 -0.758 0 O-C-N 124.856 0.974 . . . . 0.0 115.394 -172.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 0.1 OUTLIER -69.07 -45.62 69.87 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 117.218 0.509 . . . . 0.0 112.073 -175.414 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -69.29 -42.14 75.86 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.753 0.787 . . . . 0.0 109.558 -175.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -69.76 -35.57 75.04 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.383 -1.281 . . . . 0.0 109.643 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.4 ttt180 -68.23 -39.82 82.21 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 177.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -62.57 -42.72 99.72 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.779 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.9 m -58.22 -45.26 88.01 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.463 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -53.98 -53.77 48.21 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -62.13 -51.08 69.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.112 -178.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -69.78 -42.71 73.43 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -176.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.8 t -63.77 -38.68 92.01 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.687 0.279 . . . . 0.0 110.491 -177.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -76.08 -33.87 59.53 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.526 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -68.14 -38.51 82.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.646 0.736 . . . . 0.0 109.459 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . 0.437 ' HA ' ' NE ' ' A' ' 32' ' ' ARG . 4.6 tpm_? -67.32 -36.21 81.01 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.743 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.7 tp . . . . . 0 C--N 1.307 -1.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.129 -177.29 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 93.5 mttt . . . . . 0 N--CA 1.449 -0.519 0 N-CA-C 109.698 -0.482 . . . . 0.0 109.698 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.63 -37.74 88.46 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.646 -179.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.84 -46.46 81.81 Favored 'General case' 0 C--N 1.282 -2.334 0 CA-C-N 113.847 -1.524 . . . . 0.0 109.135 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -64.03 -51.89 62.02 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.56 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 pt -62.91 -39.15 83.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.6 t -61.69 -32.98 73.21 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-O 120.943 0.402 . . . . 0.0 109.923 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 8' ' ' ARG . 8.8 tpt180 -71.56 -48.5 48.13 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 174.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -54.25 -43.84 71.28 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.639 0.587 . . . . 0.0 111.145 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -52.08 -49.02 64.36 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.838 0.711 . . . . 0.0 111.727 177.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.2 m -80.29 -23.83 40.43 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 178.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 -71.26 -32.72 69.06 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -82.0 -34.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.31 -55.14 35.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.828 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -146.45 87.46 6.48 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.8 120.28 7.29 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 121.827 1.685 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 63.97 32.54 13.0 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.336 0.654 . . . . 0.0 110.381 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.44 168.29 54.51 Favored Glycine 0 N--CA 1.437 -1.28 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.042 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.58 -92.32 2.11 Favored Glycine 0 N--CA 1.421 -2.311 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' GLU . . . . . 0.487 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.5 mp0 -51.28 -51.7 51.79 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 124.367 1.067 . . . . 0.0 110.846 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.17 -35.27 77.78 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.803 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -76.2 -36.0 58.82 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.391 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -61.76 -43.92 97.9 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -56.94 -51.2 70.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.767 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 m -55.49 -39.58 70.61 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.54 -54.01 50.57 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -61.17 -42.8 99.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.769 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.2 -43.81 81.2 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 177.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.1 t -67.38 -45.89 74.92 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.432 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -68.09 -27.89 66.87 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.097 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -75.73 -34.05 60.31 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.136 0.494 . . . . 0.0 110.09 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -76.28 -53.35 8.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.242 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? . . . . . 0 C--N 1.322 -0.614 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.748 -178.38 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.68 0 CA-C-O 121.455 0.645 . . . . 0.0 110.745 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -73.96 -45.92 47.18 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.906 -177.607 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.91 -29.62 66.84 Favored 'General case' 0 CA--C 1.509 -0.61 0 CA-C-N 115.71 -0.677 . . . . 0.0 110.147 177.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.0 m -61.58 -40.02 93.25 Favored 'General case' 0 C--N 1.307 -1.261 0 CA-C-N 114.857 -1.065 . . . . 0.0 109.819 178.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -64.3 -50.39 68.06 Favored 'General case' 0 N--CA 1.444 -0.749 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.165 177.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 53.0 mt -58.18 -52.07 63.2 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.906 0 CA-C-O 121.323 0.582 . . . . 0.0 109.977 -178.715 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.2 t -52.17 -44.7 64.78 Favored 'General case' 0 C--O 1.248 0.99 0 CA-C-N 114.301 -1.318 . . . . 0.0 111.89 -179.268 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.2 -38.42 31.22 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 120.661 -0.416 . . . . 0.0 110.881 179.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -64.53 -30.28 71.31 Favored 'General case' 0 C--N 1.325 -0.496 0 N-CA-C 111.836 0.31 . . . . 0.0 111.836 -176.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 89.2 t90 -57.56 -51.73 68.28 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 173.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 45.8 m -65.91 -30.18 70.72 Favored 'General case' 0 C--O 1.192 -1.949 0 CA-C-N 115.183 -0.917 . . . . 0.0 111.893 177.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.2 tp60 -66.47 -29.24 69.32 Favored 'General case' 0 C--N 1.314 -0.969 0 CA-C-O 121.106 0.479 . . . . 0.0 110.197 179.109 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -87.08 -47.07 16.14 Favored 'Isoleucine or valine' 0 C--N 1.311 -1.094 0 CA-C-N 116.158 -0.474 . . . . 0.0 110.291 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 13.5 tpt -71.61 -42.01 68.22 Favored 'General case' 0 C--N 1.321 -0.673 0 N-CA-C 112.106 0.41 . . . . 0.0 112.106 -175.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt -136.35 83.84 30.8 Favored Pre-proline 0 C--N 1.312 -1.04 0 N-CA-C 109.771 -0.455 . . . . 0.0 109.771 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -77.71 119.12 4.7 Favored 'Trans proline' 0 N--CA 1.45 -1.053 0 C-N-CA 122.422 2.082 . . . . 0.0 112.583 -176.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 46.61 75.87 0.11 Allowed 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.654 1.182 . . . . 0.0 113.292 175.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -111.82 -143.42 9.14 Favored Glycine 0 C--N 1.301 -1.375 0 N-CA-C 111.067 -0.813 . . . . 0.0 111.067 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -128.89 -80.45 0.27 Allowed Glycine 0 C--N 1.297 -1.619 0 N-CA-C 109.19 -1.564 . . . . 0.0 109.19 176.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 18.4 tp10 -64.99 -28.39 69.48 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 177.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.4 mp0 -56.11 -43.06 77.77 Favored 'General case' 0 N--CA 1.444 -0.75 0 CA-C-N 114.808 -1.087 . . . . 0.0 110.076 176.569 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 15.4 mm100 -70.47 -44.91 66.77 Favored 'General case' 0 CA--C 1.503 -0.849 0 CA-C-N 115.682 -0.69 . . . . 0.0 109.555 -178.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 86.4 mtt180 -55.96 -53.65 54.37 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 124.016 0.823 . . . . 0.0 110.342 -178.479 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.5 mtm180 -62.4 -51.55 67.11 Favored 'General case' 0 CA--C 1.505 -0.758 0 CA-C-N 115.745 -0.661 . . . . 0.0 110.728 -179.77 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 m -57.28 -48.34 79.14 Favored 'General case' 0 CA--C 1.507 -0.705 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 -178.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.8 mt-30 -65.89 -42.61 90.04 Favored 'General case' 0 C--N 1.318 -0.796 0 O-C-N 123.075 0.234 . . . . 0.0 111.009 -178.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -63.28 -51.2 67.07 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-N 116.396 -0.366 . . . . 0.0 110.528 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.489 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 1.2 tm-20 -61.89 -38.26 87.69 Favored 'General case' 0 N--CA 1.439 -1.001 0 C-N-CA 124.399 1.079 . . . . 0.0 109.657 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 39.1 t -65.23 -50.72 64.76 Favored 'General case' 0 C--N 1.32 -0.688 0 CA-C-N 116.093 -0.503 . . . . 0.0 110.126 178.73 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -64.51 -28.93 69.99 Favored 'General case' 0 C--O 1.219 -0.518 0 N-CA-C 111.696 0.258 . . . . 0.0 111.696 179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -65.48 -36.44 83.89 Favored 'General case' 0 C--N 1.316 -0.864 0 C-N-CA 123.241 0.616 . . . . 0.0 110.068 178.231 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.6 mtt180 -81.16 -55.2 4.91 Favored 'General case' 0 C--N 1.321 -0.649 0 CA-C-O 122.195 0.998 . . . . 0.0 109.769 178.412 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.5 tp -73.75 -47.43 39.2 Favored 'General case' 0 C--N 1.307 -1.268 0 CA-C-N 113.745 -1.57 . . . . 0.0 113.707 -168.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 36.3 mmt180 64.07 86.25 0.13 Allowed 'General case' 0 C--O 1.241 0.624 0 CA-C-O 122.032 0.92 . . . . 0.0 110.192 -172.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 32.7 t70 . . . . . 0 C--N 1.304 -1.406 0 CA-C-N 114.84 -1.073 . . . . 0.0 108.409 -178.239 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.747 0 CA-C-O 121.377 0.608 . . . . 0.0 110.812 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.472 ' O ' HG13 ' A' ' 6' ' ' ILE . 65.8 mttm -79.61 -13.16 59.71 Favored 'General case' 0 N--CA 1.425 -1.713 0 N-CA-C 114.145 1.165 . . . . 0.0 114.145 -177.359 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.5 mm-40 -71.39 -39.54 71.1 Favored 'General case' 0 CA--C 1.508 -0.643 0 N-CA-C 107.728 -1.212 . . . . 0.0 107.728 172.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 5.4 m -68.5 -34.18 75.44 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-N 113.278 -1.783 . . . . 0.0 109.077 177.693 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -60.51 -44.22 96.26 Favored 'General case' 0 C--N 1.323 -0.57 0 CA-C-N 115.348 -0.842 . . . . 0.0 109.575 176.231 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.472 HG13 ' O ' ' A' ' 2' ' ' LYS . 86.5 mt -61.65 -54.94 28.06 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.594 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 176.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 5.0 t -48.02 -48.02 33.12 Favored 'General case' 0 C--O 1.256 1.422 0 C-N-CA 124.398 1.079 . . . . 0.0 112.093 176.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.401 ' HD3' ' C ' ' A' ' 8' ' ' ARG . 1.1 tmt_? -66.96 -44.87 79.41 Favored 'General case' 0 C--O 1.213 -0.85 0 CA-C-O 119.561 -0.257 . . . . 0.0 110.425 177.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -62.11 -30.8 71.27 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-O 121.353 0.597 . . . . 0.0 110.61 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 13.2 m95 -63.15 -55.67 23.28 Favored 'General case' 0 C--N 1.313 -0.979 0 CA-C-N 116.078 -0.51 . . . . 0.0 111.355 172.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 9.7 m -64.4 -29.98 71.03 Favored 'General case' 0 C--N 1.32 -0.696 0 N-CA-C 112.111 0.412 . . . . 0.0 112.111 178.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 44.5 tt0 -56.39 -46.84 79.93 Favored 'General case' 0 C--N 1.315 -0.897 0 C-N-CA 124.039 0.936 . . . . 0.0 110.172 176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 63.6 t -85.61 -48.14 16.32 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.916 0 CA-C-N 115.845 -0.616 . . . . 0.0 111.123 -178.577 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . 0.46 ' O ' ' HD3' ' A' ' 16' ' ' PRO . 15.3 tpt -64.92 -28.09 69.29 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 113.509 0.929 . . . . 0.0 113.509 -173.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.5 mmtt -112.88 98.4 45.06 Favored Pre-proline 0 C--N 1.312 -1.065 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -176.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . 0.46 ' HD3' ' O ' ' A' ' 14' ' ' MET . 60.6 Cg_endo -104.32 137.92 0.1 Allowed 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.417 2.744 . . . . 0.0 113.978 175.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 17.3 mt-30 70.89 -17.53 0.3 Allowed 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 115.488 1.662 . . . . 0.0 115.488 171.126 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.447 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -90.4 105.42 3.25 Favored Glycine 0 C--N 1.304 -1.205 0 C-N-CA 120.554 -0.831 . . . . 0.0 112.245 -178.67 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -61.94 -34.1 87.71 Favored Glycine 0 N--CA 1.464 0.523 0 C-N-CA 121.576 -0.345 . . . . 0.0 113.121 -177.849 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.423 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 4.6 mp0 -63.52 -44.4 94.35 Favored 'General case' 0 C--N 1.316 -0.861 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 179.483 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -64.04 -40.24 95.86 Favored 'General case' 0 C--N 1.319 -0.718 0 CA-C-N 114.72 -1.127 . . . . 0.0 109.647 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.447 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 14.8 mm100 -56.73 -56.55 19.99 Favored 'General case' 0 C--O 1.248 1.01 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.929 179.322 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 66.9 ttt180 -66.57 -39.35 88.43 Favored 'General case' 0 N--CA 1.432 -1.33 0 CA-C-N 115.521 -0.763 . . . . 0.0 111.056 -178.549 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.1 ttp180 -58.1 -53.11 61.95 Favored 'General case' 0 CA--C 1.512 -0.512 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 7.2 m -55.17 -41.98 72.57 Favored 'General case' 0 CA--C 1.509 -0.626 0 O-C-N 124.144 0.903 . . . . 0.0 112.868 179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.21 -49.01 73.66 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.977 0.418 . . . . 0.0 109.941 179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -64.58 -42.35 95.67 Favored 'General case' 0 C--N 1.313 -0.995 0 CA-C-N 115.645 -0.707 . . . . 0.0 111.982 -177.416 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -76.4 -27.25 56.25 Favored 'General case' 0 C--O 1.218 -0.556 0 C-N-CA 120.514 -0.474 . . . . 0.0 111.579 -178.067 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 15.3 t -73.12 -33.63 65.66 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 108.851 -0.796 . . . . 0.0 108.851 178.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.405 ' O ' ' HG3' ' A' ' 34' ' ' ARG . 30.9 mm-40 -63.22 -46.08 88.63 Favored 'General case' 0 C--O 1.222 -0.346 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 171.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -58.38 -38.31 77.03 Favored 'General case' 0 C--N 1.322 -0.606 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.663 179.163 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.3 tpp180 -67.42 -40.74 85.53 Favored 'General case' 0 C--N 1.314 -0.958 0 C-N-CA 123.713 0.805 . . . . 0.0 111.178 178.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 64.4 tp -74.16 -43.97 55.31 Favored 'General case' 0 C--N 1.316 -0.888 0 CA-C-N 116.13 -0.486 . . . . 0.0 111.889 -178.746 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.405 ' HG3' ' O ' ' A' ' 30' ' ' GLU . 96.9 mtt180 -69.66 119.12 13.41 Favored 'General case' 0 C--N 1.308 -1.232 0 CA-C-N 116.232 -0.44 . . . . 0.0 111.167 -176.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 10.3 m-20 . . . . . 0 CA--C 1.496 -1.113 0 N-CA-C 108.43 -0.952 . . . . 0.0 108.43 178.351 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.276 0 CA-C-O 121.203 0.525 . . . . 0.0 110.987 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 63.9 mttp -71.23 -28.08 63.94 Favored 'General case' 0 N--CA 1.449 -0.492 0 CA-C-O 121.174 0.511 . . . . 0.0 110.149 179.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 45.6 mt-10 -71.19 -25.73 62.65 Favored 'General case' 0 CA--C 1.515 -0.401 0 CA-C-N 115.441 -0.799 . . . . 0.0 110.01 177.231 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -76.83 -41.6 43.61 Favored 'General case' 0 C--N 1.292 -1.906 0 N-CA-C 108.461 -0.94 . . . . 0.0 108.461 177.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -57.63 -53.28 59.95 Favored 'General case' 0 N--CA 1.449 -0.491 0 CA-C-N 114.683 -1.144 . . . . 0.0 110.397 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 28.3 pt -68.79 -35.1 68.04 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.712 0 CA-C-N 116.169 -0.469 . . . . 0.0 111.45 -179.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.499 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 17.5 t -57.72 -42.19 83.28 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 122.818 0.447 . . . . 0.0 110.194 -178.638 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.7 tpt180 -80.56 -50.73 9.62 Favored 'General case' 0 N--CA 1.44 -0.959 0 C-N-CA 120.199 -0.6 . . . . 0.0 111.005 177.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -55.99 -39.51 71.97 Favored 'General case' 0 N--CA 1.472 0.657 0 O-C-N 123.409 0.443 . . . . 0.0 112.037 -174.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 17.9 t90 -58.04 -51.59 69.05 Favored 'General case' 0 N--CA 1.445 -0.679 0 O-C-N 123.35 0.406 . . . . 0.0 110.066 -177.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.4 m -73.14 -34.81 66.31 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 112.401 0.519 . . . . 0.0 112.401 178.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -61.2 -39.52 90.52 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-O 121.303 0.573 . . . . 0.0 110.575 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 87.5 t -82.41 -30.47 9.41 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.624 0 CA-C-N 115.94 -0.573 . . . . 0.0 110.394 178.013 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 27.6 ttt -64.72 -55.2 21.42 Favored 'General case' 0 C--N 1.323 -0.579 0 CA-C-N 115.88 -0.6 . . . . 0.0 110.346 179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.415 ' HG3' ' OE2' ' A' ' 21' ' ' GLU . 13.9 mmmm -145.26 95.06 5.14 Favored Pre-proline 0 C--N 1.317 -0.845 0 C-N-CA 123.277 0.631 . . . . 0.0 109.558 177.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.9 Cg_exo -74.39 123.09 7.94 Favored 'Trans proline' 0 N--CA 1.448 -1.162 0 C-N-CA 122.526 2.151 . . . . 0.0 110.448 178.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 68.59 177.73 0.25 Allowed 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.878 0.871 . . . . 0.0 111.872 178.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 127.25 -145.91 16.1 Favored Glycine 0 N--CA 1.432 -1.625 0 N-CA-C 110.95 -0.86 . . . . 0.0 110.95 -178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -143.88 -73.89 0.03 OUTLIER Glycine 0 N--CA 1.437 -1.291 0 C-N-CA 120.765 -0.731 . . . . 0.0 112.702 -179.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -64.73 -43.41 93.49 Favored 'General case' 0 C--N 1.319 -0.72 0 CA-C-O 121.07 0.462 . . . . 0.0 111.776 -174.215 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.415 ' OE2' ' HG3' ' A' ' 15' ' ' LYS . 40.2 mt-10 -65.46 -27.7 68.69 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.209 0.528 . . . . 0.0 110.206 -179.754 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.3 mm-40 -71.03 -39.05 72.56 Favored 'General case' 0 N--CA 1.443 -0.806 0 CA-C-N 115.645 -0.707 . . . . 0.0 109.358 -178.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 60.9 mtm180 -64.89 -45.23 86.81 Favored 'General case' 0 CA--C 1.506 -0.747 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.576 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 19.9 tpp180 -54.99 -57.32 12.18 Favored 'General case' 0 C--O 1.222 -0.361 0 O-C-N 123.996 0.81 . . . . 0.0 110.851 178.275 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 18.6 m -62.78 -31.85 72.9 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 113.448 0.907 . . . . 0.0 113.448 -179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -68.09 -47.6 67.77 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 120.912 -0.315 . . . . 0.0 110.21 176.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.28 -42.49 99.39 Favored 'General case' 0 C--O 1.245 0.822 0 CA-C-N 116.268 -0.424 . . . . 0.0 110.47 -179.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.576 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 47.5 mm-40 -61.98 -49.52 75.75 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-N 116.123 -0.49 . . . . 0.0 110.098 177.571 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.6 t -66.7 -55.26 15.95 Favored 'General case' 0 C--N 1.315 -0.914 0 CA-C-N 115.687 -0.688 . . . . 0.0 112.245 -175.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.2 mt-10 -64.75 -32.65 74.42 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -173.849 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 38.6 mt-10 -84.31 -17.53 39.26 Favored 'General case' 0 C--N 1.314 -0.973 0 C-N-CA 119.009 -1.077 . . . . 0.0 112.525 178.382 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 18.3 tpp180 -81.26 -40.58 23.52 Favored 'General case' 0 C--N 1.312 -1.029 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 176.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 62.7 tp -75.25 -36.53 61.26 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 115.335 -0.848 . . . . 0.0 109.905 177.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.401 ' HD2' ' HA ' ' A' ' 34' ' ' ARG . 23.0 mmm180 76.3 -75.32 0.07 Allowed 'General case' 0 CA--C 1.504 -0.792 0 C-N-CA 124.927 1.291 . . . . 0.0 112.634 -178.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.3 t70 . . . . . 0 C--N 1.29 -2.017 0 N-CA-C 109.693 -0.484 . . . . 0.0 109.693 -179.58 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.449 -0.517 0 CA-C-O 121.151 0.5 . . . . 0.0 110.478 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 75.5 mmtt -72.66 -49.63 30.43 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-N 115.762 -0.654 . . . . 0.0 109.451 -178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.454 ' O ' ' HB2' ' A' ' 7' ' ' CYS . 0.0 OUTLIER -65.14 -27.86 69.02 Favored 'General case' 0 C--N 1.322 -0.598 0 CA-C-N 115.633 -0.712 . . . . 0.0 110.171 -178.137 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.8 m -72.24 -48.08 45.49 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-N 114.864 -1.062 . . . . 0.0 110.399 179.373 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.0 tp10 -60.93 -48.9 79.71 Favored 'General case' 0 C--O 1.219 -0.54 0 N-CA-C 109.348 -0.612 . . . . 0.0 109.348 178.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.45 -40.05 82.99 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.027 0 CA-C-N 116.546 -0.297 . . . . 0.0 111.089 178.227 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' A' ' 3' ' ' GLU . 26.2 t -55.03 -47.82 74.22 Favored 'General case' 0 C--O 1.248 1.006 0 CA-C-N 115.642 -0.708 . . . . 0.0 110.6 -178.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 8.3 tpt180 -80.02 -39.25 30.31 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.501 178.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.428 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.7 tt0 -58.74 -37.62 76.6 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.5 0.72 . . . . 0.0 111.799 -177.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 84.1 t90 -60.02 -52.23 66.28 Favored 'General case' 0 C--N 1.322 -0.624 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 178.55 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.3 m -69.88 -28.66 65.83 Favored 'General case' 0 C--N 1.309 -1.186 0 CA-C-N 115.785 -0.643 . . . . 0.0 111.885 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.428 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 7.6 tt0 -57.89 -47.3 83.18 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 124.023 0.929 . . . . 0.0 110.079 177.136 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 35.0 m -87.05 -25.1 6.23 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.735 0 C-N-CA 120.527 -0.469 . . . . 0.0 111.877 -179.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 50.1 tpp -75.96 -49.24 18.26 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 116.578 -0.283 . . . . 0.0 111.479 -178.448 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 mmtp -134.85 80.57 48.83 Favored Pre-proline 0 C--N 1.32 -0.705 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -178.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 9.6 Cg_exo -71.87 118.66 5.75 Favored 'Trans proline' 0 C--O 1.248 0.987 0 C-N-CA 121.749 1.633 . . . . 0.0 111.249 -176.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 59.68 20.43 9.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.943 0.897 . . . . 0.0 112.702 179.338 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -87.26 75.51 2.15 Favored Glycine 0 C--O 1.217 -0.925 0 N-CA-C 110.911 -0.876 . . . . 0.0 110.911 -179.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -30.11 -54.83 0.22 Allowed Glycine 0 N--CA 1.479 1.535 0 C-N-CA 126.212 1.863 . . . . 0.0 117.093 -173.47 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -61.78 -55.81 26.1 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 117.87 0.835 . . . . 0.0 111.399 -177.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -73.68 -21.53 60.23 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-N 115.402 -0.817 . . . . 0.0 110.819 -177.32 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 30.1 tt0 -72.78 -41.73 64.69 Favored 'General case' 0 C--N 1.306 -1.296 0 CA-C-N 115.451 -0.795 . . . . 0.0 109.616 176.233 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 19.7 mmm180 -70.93 -30.57 66.93 Favored 'General case' 0 CA--C 1.509 -0.629 0 N-CA-C 110.162 -0.31 . . . . 0.0 110.162 175.738 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.435 ' O ' ' HG3' ' A' ' 28' ' ' GLU . 20.6 tpp180 -57.93 -50.24 74.04 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 107.605 -1.257 . . . . 0.0 107.605 171.695 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 8.6 m -58.67 -40.47 83.6 Favored 'General case' 0 C--O 1.211 -0.935 0 CA-C-N 115.151 -0.931 . . . . 0.0 112.402 175.474 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 15.0 mm100 -59.37 -47.59 84.84 Favored 'General case' 0 C--N 1.324 -0.537 0 O-C-N 123.043 0.214 . . . . 0.0 110.472 178.244 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 50.2 tt0 -60.34 -49.59 76.97 Favored 'General case' 0 C--N 1.326 -0.45 0 O-C-N 123.98 0.8 . . . . 0.0 110.276 178.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.435 ' HG3' ' O ' ' A' ' 24' ' ' ARG . 44.2 mt-10 -64.33 -34.07 77.3 Favored 'General case' 0 C--O 1.214 -0.793 0 CA-C-N 116.024 -0.535 . . . . 0.0 111.19 -179.211 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.1 t -70.02 -41.48 74.24 Favored 'General case' 0 C--N 1.313 -0.978 0 N-CA-C 109.762 -0.458 . . . . 0.0 109.762 -179.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.4 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 46.6 mt-10 -63.21 -40.97 98.99 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -72.44 -19.36 61.59 Favored 'General case' 0 CA--C 1.555 1.14 0 CA-C-N 115.408 -0.815 . . . . 0.0 111.118 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 38.2 ttm180 -86.05 -50.42 7.05 Favored 'General case' 0 C--N 1.314 -0.963 0 CA-C-O 121.088 0.471 . . . . 0.0 110.289 179.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 82.9 mt -71.49 -36.9 71.28 Favored 'General case' 0 C--N 1.318 -0.763 0 CA-C-N 115.648 -0.706 . . . . 0.0 111.389 -175.679 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 70.0 mtt180 -90.65 146.29 24.15 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 109.541 -0.54 . . . . 0.0 109.541 179.531 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 20.9 t70 . . . . . 0 C--N 1.287 -2.122 0 N-CA-C 107.497 -1.297 . . . . 0.0 107.497 178.076 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 -0.263 0 CA-C-O 121.003 0.43 . . . . 0.0 111.64 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 25.2 mtpp -68.38 -26.12 65.41 Favored 'General case' 0 N--CA 1.444 -0.729 0 N-CA-C 113.237 0.829 . . . . 0.0 113.237 -175.608 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 41.5 mt-10 -63.55 -31.37 72.52 Favored 'General case' 0 C--O 1.242 0.678 0 CA-C-O 121.424 0.63 . . . . 0.0 110.237 176.465 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.3 m -79.08 -33.43 44.53 Favored 'General case' 0 C--N 1.3 -1.583 0 CA-C-N 114.791 -1.095 . . . . 0.0 109.949 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 37.8 mt-10 -63.16 -51.6 65.78 Favored 'General case' 0 CA--C 1.507 -0.684 0 CA-C-N 116.588 -0.278 . . . . 0.0 110.33 178.787 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 69.2 mt -56.3 -46.31 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.593 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 177.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.2 t -54.2 -51.0 65.79 Favored 'General case' 0 C--O 1.256 1.398 0 CA-C-N 113.855 -1.521 . . . . 0.0 112.041 178.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.0 tpt180 -65.55 -43.0 91.24 Favored 'General case' 0 C--N 1.34 0.189 0 O-C-N 122.528 -0.108 . . . . 0.0 110.773 178.387 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 82.4 mm-40 -61.25 -39.27 89.74 Favored 'General case' 0 C--O 1.241 0.652 0 N-CA-C 112.51 0.559 . . . . 0.0 112.51 -177.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 85.3 t90 -61.96 -54.39 42.35 Favored 'General case' 0 N--CA 1.447 -0.58 0 O-C-N 123.575 0.547 . . . . 0.0 109.525 178.032 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 6.1 m -64.24 -29.91 70.98 Favored 'General case' 0 C--O 1.203 -1.395 0 N-CA-C 113.01 0.745 . . . . 0.0 113.01 179.347 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -66.06 -40.87 91.26 Favored 'General case' 0 C--N 1.313 -1.003 0 CA-C-O 120.896 0.379 . . . . 0.0 110.765 179.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.8 p -89.06 -38.6 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.996 0 N-CA-C 112.716 0.636 . . . . 0.0 112.716 -179.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 94.5 mmm -80.59 -25.33 38.55 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 112.13 0.419 . . . . 0.0 112.13 -176.007 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -119.17 96.13 49.82 Favored Pre-proline 0 C--N 1.309 -1.184 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 179.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 10.6 Cg_endo -94.66 120.0 0.29 Allowed 'Trans proline' 0 N--CA 1.445 -1.377 0 C-N-CA 122.067 1.844 . . . . 0.0 111.989 176.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 68.28 -176.21 0.2 Allowed 'General case' 0 C--O 1.219 -0.505 0 C-N-CA 123.908 0.883 . . . . 0.0 112.048 176.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 112.17 -41.68 2.16 Favored Glycine 0 C--N 1.297 -1.599 0 C-N-CA 121.208 -0.52 . . . . 0.0 111.805 177.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.63 -64.52 3.83 Favored Glycine 0 C--N 1.301 -1.405 0 C-N-CA 121.329 -0.462 . . . . 0.0 112.285 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -68.27 -40.24 81.93 Favored 'General case' 0 C--N 1.322 -0.602 0 C-N-CA 123.053 0.541 . . . . 0.0 111.093 -179.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.9 tp10 -62.87 -36.17 82.42 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.649 0.738 . . . . 0.0 109.178 178.056 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 7.3 mm100 -72.4 -41.2 66.55 Favored 'General case' 0 C--N 1.324 -0.53 0 CA-C-N 114.7 -1.136 . . . . 0.0 108.698 -179.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.528 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 29.0 tpt180 -56.34 -50.16 72.28 Favored 'General case' 0 N--CA 1.44 -0.967 0 CA-C-N 115.052 -0.977 . . . . 0.0 108.949 176.597 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 13.6 tpp180 -59.01 -42.24 89.65 Favored 'General case' 0 N--CA 1.451 -0.416 0 CA-C-N 115.656 -0.702 . . . . 0.0 110.304 179.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.9 m -54.3 -54.99 32.79 Favored 'General case' 0 C--O 1.215 -0.742 0 O-C-N 123.674 0.609 . . . . 0.0 112.021 175.53 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -67.78 -33.64 75.22 Favored 'General case' 0 C--N 1.32 -0.684 0 N-CA-C 112.554 0.575 . . . . 0.0 112.554 -178.336 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 14.0 mm100 -62.12 -49.75 74.63 Favored 'General case' 0 CA--C 1.516 -0.327 0 N-CA-C 109.908 -0.405 . . . . 0.0 109.908 176.423 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -70.88 -29.62 65.77 Favored 'General case' 0 C--N 1.325 -0.49 0 CA-C-N 116.24 -0.437 . . . . 0.0 111.518 -179.722 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 11.2 t -63.79 -51.69 63.63 Favored 'General case' 0 C--N 1.307 -1.267 0 CA-C-N 115.892 -0.595 . . . . 0.0 109.423 179.064 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -71.55 -25.31 62.16 Favored 'General case' 0 N--CA 1.447 -0.604 0 CA-C-N 116.194 -0.457 . . . . 0.0 110.891 178.411 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -64.66 -42.38 95.44 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 108.999 -0.741 . . . . 0.0 108.999 176.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 49.0 ttt180 -68.47 -37.93 80.59 Favored 'General case' 0 C--O 1.239 0.531 0 CA-C-N 115.631 -0.713 . . . . 0.0 109.925 177.495 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 53.5 tp -62.55 -34.73 77.53 Favored 'General case' 0 C--O 1.24 0.584 0 CA-C-N 115.61 -0.723 . . . . 0.0 109.204 176.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 67.4 ttt180 76.64 121.74 0.05 OUTLIER 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 125.578 1.551 . . . . 0.0 111.971 172.621 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 40.7 m-20 . . . . . 0 C--O 1.252 1.228 0 C-N-CA 124.804 1.242 . . . . 0.0 109.664 -178.598 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.468 0 CA-C-O 120.785 0.326 . . . . 0.0 110.732 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.462 ' O ' HG13 ' A' ' 6' ' ' ILE . 98.8 mttt -72.97 -42.18 63.6 Favored 'General case' 0 N--CA 1.445 -0.702 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.32 -177.775 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 15.0 tp10 -68.86 -32.74 72.62 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 108.208 -1.034 . . . . 0.0 108.208 179.56 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.9 m -64.88 -43.79 91.79 Favored 'General case' 0 C--N 1.301 -1.538 0 CA-C-N 114.077 -1.42 . . . . 0.0 109.554 176.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -64.44 -43.76 93.29 Favored 'General case' 0 N--CA 1.444 -0.767 0 CA-C-N 115.269 -0.878 . . . . 0.0 110.274 -178.626 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.462 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.4 mt -61.55 -50.39 80.52 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 177.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 19.4 t -51.52 -43.53 62.31 Favored 'General case' 0 C--O 1.241 0.654 0 CA-C-N 114.74 -1.118 . . . . 0.0 111.008 179.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.4 tpt180 -72.91 -46.48 52.4 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 120.607 -0.437 . . . . 0.0 111.222 177.511 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 8.5 tp-100 -59.14 -41.89 89.36 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 112.537 0.569 . . . . 0.0 112.537 -174.311 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 78.6 t90 -55.5 -48.38 74.7 Favored 'General case' 0 N--CA 1.462 0.151 0 O-C-N 123.609 0.568 . . . . 0.0 110.327 -178.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 87.6 m -77.65 -30.02 51.95 Favored 'General case' 0 C--N 1.306 -1.293 0 CA-C-N 116.15 -0.477 . . . . 0.0 111.733 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 22.9 tp60 -67.45 -41.39 84.79 Favored 'General case' 0 N--CA 1.446 -0.63 0 CA-C-N 116.479 -0.328 . . . . 0.0 110.963 -178.429 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 7.1 p -84.02 -20.68 8.77 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.784 0 CA-C-O 121.176 0.513 . . . . 0.0 110.01 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 22.4 ttt -60.95 -54.49 44.32 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 109.119 -0.697 . . . . 0.0 109.119 175.763 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 22.5 tptm -153.62 101.12 2.55 Favored Pre-proline 0 N--CA 1.428 -1.554 0 CA-C-N 115.814 -0.63 . . . . 0.0 109.977 176.971 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -61.29 119.64 6.89 Favored 'Trans proline' 0 N--CA 1.451 -1.003 0 C-N-CA 121.96 1.773 . . . . 0.0 108.978 173.678 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 80.1 mt-30 59.53 74.6 0.44 Allowed 'General case' 0 C--O 1.245 0.816 0 C-N-CA 123.827 0.851 . . . . 0.0 111.398 -175.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -105.54 164.14 14.04 Favored Glycine 0 N--CA 1.43 -1.71 0 N-CA-C 110.185 -1.166 . . . . 0.0 110.185 178.541 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -99.8 -92.15 2.07 Favored Glycine 0 N--CA 1.425 -2.06 0 C-N-CA 120.87 -0.681 . . . . 0.0 111.992 -179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -63.56 -46.87 83.94 Favored 'General case' 0 CA--C 1.541 0.6 0 C-N-CA 123.452 0.701 . . . . 0.0 111.75 -174.491 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.5 mm-40 -65.36 -38.32 89.71 Favored 'General case' 0 CA--C 1.512 -0.519 0 CA-C-O 120.789 0.328 . . . . 0.0 111.535 -179.376 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.456 ' O ' ' HG3' ' A' ' 26' ' ' GLN . 26.3 tt0 -70.45 -32.9 70.65 Favored 'General case' 0 C--N 1.315 -0.905 0 N-CA-C 109.244 -0.65 . . . . 0.0 109.244 179.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 42.1 ttm180 -64.2 -42.19 96.74 Favored 'General case' 0 C--O 1.246 0.879 0 N-CA-C 109.233 -0.654 . . . . 0.0 109.233 175.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 54.6 ttp85 -57.68 -48.17 80.26 Favored 'General case' 0 CA--C 1.515 -0.39 0 CA-C-N 115.359 -0.837 . . . . 0.0 109.485 174.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 58.3 m -55.74 -40.69 72.86 Favored 'General case' 0 C--N 1.321 -0.65 0 CA-C-N 115.584 -0.735 . . . . 0.0 112.72 178.031 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.507 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 78.1 mt-30 -57.34 -51.22 70.29 Favored 'General case' 0 CA--C 1.516 -0.352 0 O-C-N 123.349 0.405 . . . . 0.0 109.991 177.748 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 59.7 tt0 -63.54 -49.56 73.0 Favored 'General case' 0 C--N 1.322 -0.595 0 CA-C-N 115.482 -0.781 . . . . 0.0 111.052 -178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -60.34 -47.94 83.87 Favored 'General case' 0 C--O 1.212 -0.903 0 CA-C-N 116.238 -0.437 . . . . 0.0 111.06 -179.39 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.404 ' O ' ' HB3' ' A' ' 33' ' ' LEU . 7.7 t -63.02 -42.75 99.88 Favored 'General case' 0 C--N 1.318 -0.777 0 O-C-N 122.941 0.15 . . . . 0.0 110.985 -175.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.507 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 49.1 mt-10 -64.7 -39.96 94.55 Favored 'General case' 0 CA--C 1.514 -0.429 0 C-N-CA 120.547 -0.461 . . . . 0.0 111.953 -179.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -87.15 -29.29 21.91 Favored 'General case' 0 C--N 1.312 -1.06 0 C-N-CA 120.295 -0.562 . . . . 0.0 112.286 -174.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 39.0 ttm180 -80.52 -44.46 19.07 Favored 'General case' 0 C--N 1.31 -1.137 0 CA-C-O 121.104 0.478 . . . . 0.0 110.617 -179.234 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.404 ' HB3' ' O ' ' A' ' 29' ' ' CYS . 45.1 tp -81.65 -48.36 11.81 Favored 'General case' 0 C--N 1.307 -1.282 0 CA-C-N 116.221 -0.445 . . . . 0.0 110.219 -179.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 73.1 mtp180 62.03 176.92 0.13 Allowed 'General case' 0 C--O 1.248 0.974 0 C-N-CA 124.159 0.984 . . . . 0.0 112.712 -176.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.4 t70 . . . . . 0 C--N 1.299 -1.605 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 174.292 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.486 ' O ' ' HG2' ' A' ' 5' ' ' GLU . . . . . . . . 0 CA--C 1.514 -0.407 0 CA-C-O 120.776 0.322 . . . . 0.0 111.619 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 86.5 tttt -69.69 -39.17 77.1 Favored 'General case' 0 N--CA 1.443 -0.798 0 N-CA-C 109.898 -0.408 . . . . 0.0 109.898 -178.582 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -66.25 -26.45 67.36 Favored 'General case' 0 CA--C 1.514 -0.441 0 CA-C-O 121.338 0.589 . . . . 0.0 110.699 179.12 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 32.1 m -70.48 -47.88 58.44 Favored 'General case' 0 C--N 1.295 -1.778 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.372 175.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.486 ' HG2' ' O ' ' A' ' 1' ' ' PCA . 16.0 mm-40 -62.67 -49.36 75.44 Favored 'General case' 0 C--O 1.219 -0.516 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.776 -177.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 75.4 mt -57.11 -53.33 44.64 Favored 'Isoleucine or valine' 0 C--O 1.245 0.833 0 CA-C-O 121.619 0.723 . . . . 0.0 109.662 178.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 42.4 t -58.25 -49.26 77.73 Favored 'General case' 0 C--N 1.309 -1.195 0 CA-C-N 114.372 -1.285 . . . . 0.0 112.253 -179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -67.51 -41.56 84.25 Favored 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 112.053 0.39 . . . . 0.0 112.053 -179.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.0 tt0 -56.57 -36.79 69.75 Favored 'General case' 0 C--N 1.322 -0.591 0 O-C-N 123.312 0.382 . . . . 0.0 110.614 -178.457 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 73.4 t90 -59.66 -49.87 76.06 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.829 179.416 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.9 m -74.21 -27.34 60.74 Favored 'General case' 0 C--N 1.312 -1.059 0 CA-C-N 116.009 -0.541 . . . . 0.0 111.924 179.805 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.2 tp60 -69.62 -43.6 72.37 Favored 'General case' 0 C--N 1.321 -0.663 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 14.4 p -78.16 -20.46 13.5 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.556 0 CA-C-O 121.338 0.589 . . . . 0.0 109.837 178.433 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 47.8 tpp -71.15 -49.38 44.55 Favored 'General case' 0 C--O 1.242 0.69 0 CA-C-N 115.767 -0.651 . . . . 0.0 109.688 177.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 23.5 tptm -151.88 107.88 2.86 Favored Pre-proline 0 N--CA 1.43 -1.47 0 CA-C-N 115.878 -0.601 . . . . 0.0 110.311 -179.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -57.58 139.78 91.3 Favored 'Trans proline' 0 C--O 1.251 1.162 0 C-N-CA 122.704 2.269 . . . . 0.0 109.566 174.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 68.13 -67.21 0.2 Allowed 'General case' 0 C--N 1.321 -0.642 0 C-N-CA 124.683 1.193 . . . . 0.0 109.944 -172.059 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.484 ' HA3' ' HB2' ' A' ' 22' ' ' GLN . . . 87.71 -52.87 4.26 Favored Glycine 0 N--CA 1.436 -1.306 0 CA-C-N 116.578 -0.283 . . . . 0.0 112.919 176.747 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.39 -114.84 6.58 Favored Glycine 0 C--N 1.308 -1.009 0 N-CA-C 110.494 -1.043 . . . . 0.0 110.494 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -67.4 -29.04 68.44 Favored 'General case' 0 C--N 1.322 -0.62 0 CA-C-N 117.153 0.477 . . . . 0.0 110.371 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 42.3 mt-10 -71.94 -31.37 66.27 Favored 'General case' 0 N--CA 1.441 -0.877 0 CA-C-N 115.913 -0.585 . . . . 0.0 110.158 178.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.484 ' HB2' ' HA3' ' A' ' 18' ' ' GLY . 4.4 tp-100 -76.17 -36.86 58.5 Favored 'General case' 0 C--O 1.208 -1.083 0 N-CA-C 107.86 -1.163 . . . . 0.0 107.86 -179.764 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.561 ' O ' ' HG3' ' A' ' 27' ' ' GLN . 68.7 mtt180 -65.61 -39.36 91.45 Favored 'General case' 0 C--N 1.32 -0.714 0 CA-C-N 115.42 -0.809 . . . . 0.0 110.298 176.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 48.3 ttp180 -64.42 -43.76 93.35 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 109.568 -0.53 . . . . 0.0 109.568 174.585 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 5.1 m -60.32 -39.52 87.34 Favored 'General case' 0 C--O 1.2 -1.503 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.403 174.771 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.1 tt0 -58.22 -46.2 86.31 Favored 'General case' 0 C--N 1.324 -0.526 0 C-N-CA 123.296 0.638 . . . . 0.0 109.973 177.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.561 ' HG3' ' O ' ' A' ' 23' ' ' ARG . 18.8 mt-30 -55.73 -52.87 62.42 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.802 0.689 . . . . 0.0 109.612 178.187 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 25.2 mm-40 -65.89 -39.6 90.79 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 114.979 -1.01 . . . . 0.0 111.357 -178.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 4.5 t -65.42 -43.46 90.42 Favored 'General case' 0 C--N 1.313 -0.981 0 C-N-CA 122.905 0.482 . . . . 0.0 110.263 -177.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 70.5 mm-40 -62.85 -47.1 84.82 Favored 'General case' 0 N--CA 1.445 -0.724 0 CA-C-N 116.203 -0.453 . . . . 0.0 109.832 176.686 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -61.49 -38.32 86.87 Favored 'General case' 0 C--O 1.241 0.647 0 C-N-CA 123.456 0.702 . . . . 0.0 110.979 -179.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 57.2 ttt180 -63.47 -45.42 90.89 Favored 'General case' 0 C--N 1.31 -1.124 0 C-N-CA 123.813 0.845 . . . . 0.0 110.317 175.642 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 40.1 tp -69.65 -47.94 61.58 Favored 'General case' 0 C--N 1.315 -0.928 0 CA-C-N 115.651 -0.704 . . . . 0.0 111.439 -177.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 1.1 ttp180 -167.72 131.39 1.71 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 109.428 -0.582 . . . . 0.0 109.428 -178.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 26.2 t70 . . . . . 0 C--N 1.3 -1.586 0 N-CA-C 108.875 -0.787 . . . . 0.0 108.875 175.708 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.514 -0.42 0 CA-C-O 121.082 0.467 . . . . 0.0 111.739 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.421 ' NZ ' ' HB2' ' A' ' 2' ' ' LYS . 10.1 mtmp? -72.36 -38.57 68.53 Favored 'General case' 0 C--N 1.318 -0.784 0 CA-C-O 121.747 0.784 . . . . 0.0 108.946 178.131 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . 0.591 ' H ' ' CD ' ' A' ' 3' ' ' GLU . 2.1 mp0 -54.25 -52.38 61.51 Favored 'General case' 0 C--N 1.313 -0.987 0 C-N-CA 125.864 1.666 . . . . 0.0 109.574 -178.693 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.6 p -72.85 -34.92 67.09 Favored 'General case' 0 C--N 1.275 -2.635 0 CA-C-N 113.197 -1.819 . . . . 0.0 111.824 -179.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -59.14 -52.27 66.44 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 122.593 0.357 . . . . 0.0 110.464 179.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 78.0 mt -60.88 -50.78 79.11 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 N-CA-C 108.904 -0.776 . . . . 0.0 108.904 179.644 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 44.5 t -52.98 -47.0 68.51 Favored 'General case' 0 CA--C 1.556 1.18 0 CA-C-N 114.131 -1.395 . . . . 0.0 111.18 179.448 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 4.9 tpm_? -61.92 -48.29 81.08 Favored 'General case' 0 CA--C 1.511 -0.541 0 C-N-CA 123.863 0.865 . . . . 0.0 110.529 175.32 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 26.9 tt0 -61.72 -37.5 84.42 Favored 'General case' 0 C--N 1.316 -0.866 0 O-C-N 123.925 0.765 . . . . 0.0 111.686 -175.106 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 86.6 t90 -56.71 -53.04 62.31 Favored 'General case' 0 C--O 1.243 0.757 0 CA-C-O 121.477 0.656 . . . . 0.0 109.738 177.222 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 66.7 m -66.66 -37.61 85.14 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.429 -0.805 . . . . 0.0 111.238 177.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 -64.79 -44.3 90.41 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 115.66 -0.7 . . . . 0.0 111.394 -175.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 11.5 p -73.16 -29.86 29.66 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 C-N-CA 120.735 -0.386 . . . . 0.0 110.156 179.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 17.2 tpt -69.42 -54.66 13.25 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 116.265 -0.425 . . . . 0.0 110.511 178.735 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -148.87 108.11 3.47 Favored Pre-proline 0 C--N 1.321 -0.672 0 C-N-CA 123.751 0.82 . . . . 0.0 109.604 -179.819 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 18.2 Cg_exo -66.5 119.45 6.48 Favored 'Trans proline' 0 N--CA 1.453 -0.904 0 C-N-CA 121.82 1.68 . . . . 0.0 111.668 177.918 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 71.3 mt-30 51.11 -95.43 0.04 OUTLIER 'General case' 0 C--N 1.324 -0.535 0 C-N-CA 126.177 1.791 . . . . 0.0 114.272 177.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 71.48 -115.24 5.55 Favored Glycine 0 N--CA 1.439 -1.152 0 N-CA-C 111.582 -0.607 . . . . 0.0 111.582 -177.307 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -161.88 -80.61 0.04 OUTLIER Glycine 0 N--CA 1.415 -2.712 0 N-CA-C 110.852 -0.899 . . . . 0.0 110.852 178.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -65.0 -31.86 73.3 Favored 'General case' 0 C--N 1.323 -0.576 0 N-CA-C 112.222 0.453 . . . . 0.0 112.222 -174.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -70.75 -41.07 72.28 Favored 'General case' 0 N--CA 1.44 -0.955 0 N-CA-C 110.18 -0.304 . . . . 0.0 110.18 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -73.66 -37.92 65.13 Favored 'General case' 0 N--CA 1.439 -0.989 0 CA-C-N 116.303 -0.408 . . . . 0.0 110.481 -179.23 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.473 ' HD3' ' OE1' ' A' ' 26' ' ' GLN . 39.9 mmt180 -63.93 -41.04 97.74 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 109.976 -0.379 . . . . 0.0 109.976 177.078 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.445 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 51.0 ttp180 -63.68 -46.7 84.36 Favored 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.075 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 43.9 m -57.89 -34.48 69.84 Favored 'General case' 0 C--O 1.2 -1.544 0 N-CA-C 113.237 0.828 . . . . 0.0 113.237 177.859 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.473 ' OE1' ' HD3' ' A' ' 23' ' ' ARG . 54.6 mt-30 -60.64 -49.63 76.74 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 118.364 0.529 . . . . 0.0 110.355 176.109 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 29.4 mm-40 -62.41 -46.79 86.99 Favored 'General case' 0 C--N 1.325 -0.457 0 CA-C-N 115.923 -0.58 . . . . 0.0 110.474 178.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.589 ' O ' ' HG2' ' A' ' 32' ' ' ARG . 23.2 mm-40 -63.3 -46.91 84.53 Favored 'General case' 0 C--N 1.319 -0.736 0 C-N-CA 123.191 0.596 . . . . 0.0 111.689 -179.535 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 10.5 t -65.37 -44.52 87.36 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 122.774 0.43 . . . . 0.0 111.0 -175.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.8 mt-10 -72.15 -25.09 61.57 Favored 'General case' 0 N--CA 1.443 -0.816 0 C-N-CA 120.604 -0.439 . . . . 0.0 110.656 179.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -67.31 -39.58 85.91 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 174.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.589 ' HG2' ' O ' ' A' ' 28' ' ' GLU . 13.1 mmt180 -67.6 -38.08 83.49 Favored 'General case' 0 C--O 1.216 -0.685 0 CA-C-N 115.672 -0.694 . . . . 0.0 109.55 176.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 46.9 tp -70.49 -25.45 63.16 Favored 'General case' 0 C--N 1.309 -1.168 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.729 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 7.0 tpm_? -82.98 -8.18 59.59 Favored 'General case' 0 C--N 1.323 -0.547 0 CA-C-N 116.147 -0.479 . . . . 0.0 110.598 -178.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.4 t70 . . . . . 0 C--N 1.307 -1.267 0 CA-C-O 118.797 -0.62 . . . . 0.0 110.51 -178.978 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.288 0 CA-C-O 121.299 0.571 . . . . 0.0 110.855 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.3 mttt -63.64 -53.42 51.77 Favored 'General case' 0 C--O 1.252 1.2 0 CA-C-N 115.577 -0.738 . . . . 0.0 111.448 -177.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -79.05 -13.61 59.66 Favored 'General case' 0 C--N 1.319 -0.735 0 C-N-CA 119.407 -0.917 . . . . 0.0 110.768 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 80.7 m -65.54 -45.17 84.42 Favored 'General case' 0 N--CA 1.442 -0.855 0 N-CA-C 108.547 -0.909 . . . . 0.0 108.547 173.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 46.1 mm-40 -59.25 -47.27 85.99 Favored 'General case' 0 CA--C 1.51 -0.585 0 CA-C-N 115.575 -0.739 . . . . 0.0 110.203 176.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 64.2 mt -58.2 -54.88 26.59 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 115.931 -0.577 . . . . 0.0 110.072 179.18 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.3 t -54.98 -48.74 72.89 Favored 'General case' 0 C--N 1.314 -0.95 0 CA-C-N 114.418 -1.264 . . . . 0.0 111.796 -178.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.5 tpt180 -66.95 -46.96 73.12 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 116.387 -0.37 . . . . 0.0 111.118 -179.324 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.411 ' O ' HG22 ' A' ' 13' ' ' VAL . 6.8 tp60 -57.46 -38.52 74.61 Favored 'General case' 0 C--O 1.217 -0.61 0 O-C-N 123.594 0.559 . . . . 0.0 110.584 -177.172 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 65.5 t90 -54.94 -54.93 36.44 Favored 'General case' 0 C--O 1.249 1.057 0 C-N-CA 123.666 0.786 . . . . 0.0 110.746 178.471 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 91.4 m -70.8 -36.22 72.9 Favored 'General case' 0 C--N 1.32 -0.705 0 C-N-CA 120.765 -0.374 . . . . 0.0 111.075 177.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 -61.33 -39.33 90.12 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 123.814 0.846 . . . . 0.0 111.547 -176.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 9' ' ' GLN . 34.1 m -83.14 -30.87 8.43 Favored 'Isoleucine or valine' 0 C--N 1.316 -0.887 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.048 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 61.0 mtm -77.83 -54.09 6.74 Favored 'General case' 0 C--O 1.243 0.731 0 C-N-CA 119.368 -0.933 . . . . 0.0 111.9 -179.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -156.7 91.37 2.52 Favored Pre-proline 0 C--N 1.31 -1.121 0 N-CA-C 110.022 -0.362 . . . . 0.0 110.022 -179.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -79.0 128.74 8.54 Favored 'Trans proline' 0 N--CA 1.45 -1.04 0 C-N-CA 122.26 1.973 . . . . 0.0 113.036 -177.795 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 69.22 127.14 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.455 0 C-N-CA 124.924 1.29 . . . . 0.0 113.678 175.531 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -177.56 164.17 33.11 Favored Glycine 0 N--CA 1.431 -1.691 0 N-CA-C 109.234 -1.547 . . . . 0.0 109.234 179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -75.33 -86.87 0.28 Allowed Glycine 0 N--CA 1.438 -1.222 0 C-N-CA 120.523 -0.846 . . . . 0.0 111.351 -179.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.546 ' OE2' ' HD3' ' A' ' 23' ' ' ARG . 5.9 tp10 -70.35 -33.12 71.09 Favored 'General case' 0 C--N 1.309 -1.187 0 N-CA-C 109.371 -0.603 . . . . 0.0 109.371 -178.708 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 9.8 tp10 -58.11 -60.21 4.09 Favored 'General case' 0 C--O 1.245 0.859 0 C-N-CA 123.895 0.878 . . . . 0.0 110.922 -179.276 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' A' ' 26' ' ' GLN . 56.2 tp60 -72.39 -23.83 61.16 Favored 'General case' 0 C--O 1.2 -1.549 0 CA-C-N 115.876 -0.602 . . . . 0.0 110.019 -177.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.546 ' HD3' ' OE2' ' A' ' 20' ' ' GLU . 33.6 ttt180 -62.8 -33.96 76.29 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.933 -0.395 . . . . 0.0 109.933 174.88 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 42.0 mtm180 -63.09 -48.7 77.48 Favored 'General case' 0 CA--C 1.502 -0.878 0 N-CA-C 107.738 -1.208 . . . . 0.0 107.738 175.433 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 26.9 m -58.75 -38.45 78.44 Favored 'General case' 0 C--O 1.202 -1.397 0 CA-C-N 115.619 -0.719 . . . . 0.0 112.211 175.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 22' ' ' GLN . 14.2 mm100 -61.38 -48.86 79.34 Favored 'General case' 0 C--O 1.205 -1.251 0 N-CA-C 110.047 -0.353 . . . . 0.0 110.047 177.948 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.465 ' O ' ' HB2' ' A' ' 31' ' ' GLU . 24.8 mt-30 -63.4 -43.77 96.58 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-O 120.9 0.381 . . . . 0.0 111.586 179.391 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.648 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 6.8 mm-40 -67.48 -53.32 29.76 Favored 'General case' 0 C--N 1.305 -1.361 0 C-N-CA 120.656 -0.418 . . . . 0.0 111.156 179.672 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 6.5 t -67.3 -51.95 46.37 Favored 'General case' 0 C--N 1.302 -1.485 0 CA-C-N 116.477 -0.329 . . . . 0.0 111.192 -175.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 62.7 mm-40 -69.82 -26.76 64.4 Favored 'General case' 0 C--O 1.215 -0.711 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -174.864 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.465 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 0.7 OUTLIER -79.42 -27.51 41.76 Favored 'General case' 0 C--N 1.317 -0.824 0 C-N-CA 119.44 -0.904 . . . . 0.0 112.016 176.699 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.648 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 34.3 mtm180 -81.44 -38.89 25.72 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-O 121.263 0.554 . . . . 0.0 110.206 178.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 86.4 mt -81.36 -28.03 34.63 Favored 'General case' 0 C--N 1.309 -1.182 0 CA-C-N 115.598 -0.728 . . . . 0.0 110.857 179.55 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.6 ttp180 66.62 -87.49 0.03 OUTLIER 'General case' 0 C--O 1.244 0.798 0 C-N-CA 125.352 1.461 . . . . 0.0 110.019 -176.111 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.2 t70 . . . . . 0 C--N 1.313 -1.0 0 C-N-CA 125.716 1.606 . . . . 0.0 107.395 -175.881 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.519 -0.216 0 CA-C-O 120.653 0.263 . . . . 0.0 110.832 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.426 ' O ' HG13 ' A' ' 6' ' ' ILE . 66.3 mttm -60.29 -50.34 74.04 Favored 'General case' 0 CA--C 1.509 -0.616 0 CA-C-N 115.934 -0.575 . . . . 0.0 112.517 -176.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -67.95 -41.12 82.99 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-O 121.447 0.641 . . . . 0.0 109.415 -178.103 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 11.2 m -58.76 -42.83 89.8 Favored 'General case' 0 C--N 1.292 -1.92 0 CA-C-N 114.069 -1.423 . . . . 0.0 110.253 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 30.9 tt0 -63.38 -45.25 91.94 Favored 'General case' 0 N--CA 1.435 -1.182 0 CA-C-N 115.527 -0.76 . . . . 0.0 111.496 178.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.426 HG13 ' O ' ' A' ' 2' ' ' LYS . 58.6 mt -63.99 -50.48 77.07 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.776 0 CA-C-O 121.908 0.861 . . . . 0.0 108.741 178.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 12.0 t -52.8 -45.91 67.42 Favored 'General case' 0 C--N 1.302 -1.458 0 CA-C-N 113.864 -1.516 . . . . 0.0 112.414 179.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.76 -30.81 51.65 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 119.692 -0.803 . . . . 0.0 110.526 178.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.511 ' O ' HG23 ' A' ' 13' ' ' VAL . 23.2 tp60 -60.2 -42.85 95.97 Favored 'General case' 0 N--CA 1.469 0.503 0 N-CA-C 109.975 -0.38 . . . . 0.0 109.975 177.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 90.8 t90 -55.72 -43.84 76.91 Favored 'General case' 0 C--O 1.245 0.841 0 C-N-CA 123.649 0.78 . . . . 0.0 109.849 177.092 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 77.4 m -68.97 -36.71 78.2 Favored 'General case' 0 C--N 1.31 -1.109 0 CA-C-N 115.448 -0.796 . . . . 0.0 111.697 178.657 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -63.65 -28.73 70.11 Favored 'General case' 0 C--O 1.22 -0.477 0 CA-C-O 120.964 0.411 . . . . 0.0 111.334 175.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.511 HG23 ' O ' ' A' ' 9' ' ' GLN . 88.0 t -75.24 -38.97 42.18 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.843 0 CA-C-O 121.446 0.641 . . . . 0.0 109.347 177.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.3 ttt -68.62 -54.66 15.11 Favored 'General case' 0 C--N 1.315 -0.918 0 CA-C-N 115.351 -0.84 . . . . 0.0 110.737 -178.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -156.46 101.59 2.04 Favored Pre-proline 0 C--N 1.307 -1.28 0 N-CA-C 108.443 -0.947 . . . . 0.0 108.443 178.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 37.1 Cg_exo -57.91 118.72 5.65 Favored 'Trans proline' 0 C--O 1.252 1.195 0 C-N-CA 122.406 2.071 . . . . 0.0 111.202 -179.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 53.88 51.85 14.05 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 124.259 0.974 . . . . 0.0 110.405 -177.213 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.96 164.58 51.6 Favored Glycine 0 N--CA 1.437 -1.251 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.898 179.379 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -79.36 -95.92 0.3 Allowed Glycine 0 N--CA 1.432 -1.627 0 C-N-CA 120.747 -0.739 . . . . 0.0 111.404 179.7 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 43.5 mm-40 -69.45 -26.21 64.48 Favored 'General case' 0 C--N 1.317 -0.831 0 C-N-CA 120.786 -0.365 . . . . 0.0 111.648 -178.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 11.4 mp0 -59.22 -56.88 16.54 Favored 'General case' 0 C--O 1.217 -0.606 0 O-C-N 123.546 0.529 . . . . 0.0 110.656 176.501 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 23.5 tp60 -67.24 -29.73 69.44 Favored 'General case' 0 C--O 1.24 0.602 0 N-CA-C 110.078 -0.341 . . . . 0.0 110.078 -176.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.419 ' O ' ' HG2' ' A' ' 27' ' ' GLN . 25.5 mmm180 -63.98 -56.61 13.87 Favored 'General case' 0 C--N 1.326 -0.432 0 CA-C-N 115.682 -0.69 . . . . 0.0 110.352 174.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.9 tpp180 -59.73 -40.79 89.23 Favored 'General case' 0 CA--C 1.513 -0.467 0 O-C-N 123.414 0.447 . . . . 0.0 109.812 179.975 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.645 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 21.9 m -49.81 -56.95 8.44 Favored 'General case' 0 C--O 1.204 -1.341 0 O-C-N 124.243 0.964 . . . . 0.0 111.052 173.424 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 43.3 mt-30 -65.78 -33.93 77.0 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 111.987 0.365 . . . . 0.0 111.987 -177.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . 0.419 ' HG2' ' O ' ' A' ' 23' ' ' ARG . 15.6 mm100 -57.96 -51.01 71.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 123.261 0.351 . . . . 0.0 111.174 178.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -79.35 -29.45 42.23 Favored 'General case' 0 C--N 1.321 -0.647 0 CA-C-O 120.979 0.418 . . . . 0.0 111.163 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.645 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.6 t -62.42 -50.4 71.66 Favored 'General case' 0 C--N 1.32 -0.71 0 C-N-CA 123.417 0.687 . . . . 0.0 109.21 -179.213 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.3 mm-40 -74.07 -28.06 61.2 Favored 'General case' 0 N--CA 1.442 -0.874 0 CA-C-N 115.654 -0.703 . . . . 0.0 110.434 179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . 0.419 ' HB2' ' O ' ' A' ' 27' ' ' GLN . 14.8 tp10 -61.4 -46.24 91.0 Favored 'General case' 0 C--O 1.219 -0.532 0 CA-C-N 116.051 -0.522 . . . . 0.0 110.019 179.076 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 61.2 ttp180 -74.39 -33.3 63.0 Favored 'General case' 0 C--N 1.32 -0.713 0 CA-C-N 115.873 -0.603 . . . . 0.0 110.515 179.14 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 58.6 tp -67.08 -47.85 69.99 Favored 'General case' 0 C--N 1.323 -0.576 0 CA-C-N 115.83 -0.623 . . . . 0.0 110.441 -179.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 49.0 ttt-85 -79.97 105.5 11.3 Favored 'General case' 0 C--N 1.306 -1.316 0 N-CA-C 108.342 -0.985 . . . . 0.0 108.342 178.396 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 17.2 t70 . . . . . 0 C--N 1.299 -1.628 0 CA-C-O 118.811 -0.614 . . . . 0.0 110.1 -174.607 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.463 0 CA-C-O 120.923 0.392 . . . . 0.0 110.295 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 57.1 tptt -64.92 -45.77 84.47 Favored 'General case' 0 N--CA 1.439 -1.021 0 CA-C-N 116.031 -0.531 . . . . 0.0 110.656 -177.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -69.98 -31.61 69.39 Favored 'General case' 0 CA--C 1.506 -0.734 0 CA-C-N 115.866 -0.606 . . . . 0.0 110.37 -178.833 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 6.6 m -64.47 -49.0 73.14 Favored 'General case' 0 C--N 1.301 -1.521 0 CA-C-N 114.335 -1.302 . . . . 0.0 109.819 178.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.585 ' O ' ' HG3' ' A' ' 9' ' ' GLN . 8.3 tp10 -60.89 -48.97 79.39 Favored 'General case' 0 N--CA 1.441 -0.882 0 CA-C-N 115.702 -0.681 . . . . 0.0 110.215 -178.251 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 82.6 mt -55.72 -52.91 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.379 0 CA-C-O 121.29 0.567 . . . . 0.0 109.667 178.448 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.9 t -52.39 -47.05 66.44 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.665 178.091 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.2 tpt180 -68.72 -35.72 77.51 Favored 'General case' 0 C--O 1.2 -1.531 0 CA-C-N 115.93 -0.577 . . . . 0.0 111.614 179.327 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.585 ' HG3' ' O ' ' A' ' 5' ' ' GLU . 57.4 mt-30 -57.9 -37.67 74.43 Favored 'General case' 0 N--CA 1.487 1.394 0 CA-C-N 118.158 0.435 . . . . 0.0 111.111 -179.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -58.51 -50.62 73.09 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 115.385 -0.825 . . . . 0.0 109.057 179.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.8 m -82.04 -13.2 57.69 Favored 'General case' 0 C--N 1.311 -1.083 0 N-CA-C 113.408 0.892 . . . . 0.0 113.408 178.912 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -67.9 -34.18 76.14 Favored 'General case' 0 C--N 1.319 -0.726 0 N-CA-C 107.75 -1.204 . . . . 0.0 107.75 176.345 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.7 t -79.6 -39.72 20.64 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.812 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.252 176.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.3 mmt -68.35 -55.23 12.75 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 112.992 0.738 . . . . 0.0 112.992 -177.617 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 33.8 mmtp -136.6 87.04 21.59 Favored Pre-proline 0 C--N 1.323 -0.562 0 CA-C-O 120.871 0.367 . . . . 0.0 111.144 -176.219 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_endo -88.49 120.15 1.2 Allowed 'Trans proline' 0 N--CA 1.443 -1.489 0 C-N-CA 122.643 2.229 . . . . 0.0 110.476 176.518 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 64.55 90.59 0.08 Allowed 'General case' 0 C--O 1.241 0.649 0 C-N-CA 124.872 1.269 . . . . 0.0 111.546 -178.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -150.91 -173.17 20.68 Favored Glycine 0 N--CA 1.434 -1.447 0 C-N-CA 120.186 -1.006 . . . . 0.0 112.216 -179.298 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -113.0 -96.25 2.24 Favored Glycine 0 N--CA 1.429 -1.801 0 N-CA-C 111.064 -0.815 . . . . 0.0 111.064 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 7.6 mp0 -63.34 -41.44 98.87 Favored 'General case' 0 C--O 1.207 -1.162 0 C-N-CA 122.979 0.512 . . . . 0.0 111.126 -178.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -66.64 -32.56 73.95 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-O 121.265 0.555 . . . . 0.0 111.161 -179.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -76.21 -37.93 57.13 Favored 'General case' 0 N--CA 1.439 -1.002 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 22.4 tpt180 -64.58 -38.98 92.88 Favored 'General case' 0 N--CA 1.441 -0.889 0 CA-C-N 115.863 -0.608 . . . . 0.0 109.876 175.68 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 37.8 ttm180 -54.99 -52.22 63.77 Favored 'General case' 0 C--N 1.323 -0.587 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 176.573 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 4.4 m -64.97 -33.51 76.2 Favored 'General case' 0 C--N 1.321 -0.631 0 CA-C-N 115.517 -0.765 . . . . 0.0 113.037 177.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 61.9 tt0 -68.28 -48.85 63.91 Favored 'General case' 0 C--N 1.314 -0.973 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 178.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 35.2 tt0 -61.03 -45.3 95.34 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 123.156 0.582 . . . . 0.0 109.607 178.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -53.23 -47.2 69.2 Favored 'General case' 0 CA--C 1.51 -0.581 0 CA-C-N 115.483 -0.78 . . . . 0.0 110.809 173.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 12.2 t -70.57 -41.01 72.98 Favored 'General case' 0 N--CA 1.438 -1.035 0 CA-C-N 115.801 -0.636 . . . . 0.0 111.277 -176.31 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.472 ' HB3' ' NH1' ' A' ' 34' ' ' ARG . 48.5 mt-10 -60.7 -45.04 95.7 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 120.954 0.407 . . . . 0.0 110.52 177.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -68.57 -22.45 64.47 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-O 121.643 0.735 . . . . 0.0 110.941 178.658 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.1 ttm180 -87.88 -34.76 18.07 Favored 'General case' 0 C--N 1.304 -1.412 0 CA-C-N 115.537 -0.756 . . . . 0.0 110.546 -178.892 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 57.8 tp -76.44 -48.22 20.4 Favored 'General case' 0 C--N 1.31 -1.149 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.679 179.053 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.472 ' NH1' ' HB3' ' A' ' 30' ' ' GLU . 61.1 mtt180 -73.95 -45.94 47.16 Favored 'General case' 0 CA--C 1.501 -0.92 0 CA-C-N 116.13 -0.486 . . . . 0.0 110.598 -177.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 38.7 t70 . . . . . 0 C--N 1.311 -1.068 0 O-C-N 124.97 1.419 . . . . 0.0 111.385 -179.807 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.592 0 CA-C-O 120.972 0.415 . . . . 0.0 111.155 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 64.8 tttm -61.03 -37.75 83.71 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 124.069 0.948 . . . . 0.0 111.957 -176.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -61.24 -46.84 88.71 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-O 121.81 0.814 . . . . 0.0 110.398 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 10.0 m -74.51 -23.27 58.81 Favored 'General case' 0 C--N 1.29 -1.981 0 CA-C-N 114.908 -1.042 . . . . 0.0 110.585 -179.796 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 40.3 tt0 -66.4 -51.01 61.48 Favored 'General case' 0 C--N 1.324 -0.503 0 CA-C-N 116.569 -0.287 . . . . 0.0 110.772 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -68.27 -32.64 56.61 Favored 'Isoleucine or valine' 0 C--O 1.251 1.175 0 CA-C-O 121.492 0.663 . . . . 0.0 109.329 178.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 47.7 t -60.12 -48.17 82.85 Favored 'General case' 0 C--N 1.317 -0.841 0 CA-C-N 115.217 -0.901 . . . . 0.0 109.797 175.218 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 63.2 ttt180 -64.86 -40.99 96.01 Favored 'General case' 0 C--O 1.213 -0.858 0 N-CA-C 109.984 -0.376 . . . . 0.0 109.984 176.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.407 ' HA ' HE21 ' A' ' 12' ' ' GLN . 49.3 tt0 -50.33 -37.38 36.42 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.524 1.13 . . . . 0.0 111.706 -177.219 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 63.7 t90 -57.93 -49.18 77.63 Favored 'General case' 0 CA--C 1.547 0.852 0 CA-C-O 121.744 0.783 . . . . 0.0 109.766 178.673 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 90.5 m -78.77 -31.06 45.96 Favored 'General case' 0 C--N 1.305 -1.344 0 CA-C-N 115.377 -0.829 . . . . 0.0 111.195 -179.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.407 HE21 ' HA ' ' A' ' 9' ' ' GLN . 9.4 tt0 -63.6 -43.9 95.56 Favored 'General case' 0 C--N 1.321 -0.638 0 C-N-CA 123.786 0.835 . . . . 0.0 109.932 -178.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.7 p -78.14 -29.74 15.61 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.409 178.576 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 53.9 ttp -60.93 -55.1 36.99 Favored 'General case' 0 N--CA 1.466 0.365 0 N-CA-C 110.018 -0.364 . . . . 0.0 110.018 178.251 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.0 ttpp -157.12 108.05 1.9 Allowed Pre-proline 0 N--CA 1.439 -0.999 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 176.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -63.5 119.85 7.05 Favored 'Trans proline' 0 C--O 1.25 1.116 0 C-N-CA 122.121 1.881 . . . . 0.0 111.471 179.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 33.5 mm-40 69.46 173.35 0.3 Allowed 'General case' 0 C--O 1.252 1.208 0 C-N-CA 124.51 1.124 . . . . 0.0 112.507 -179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 155.36 166.67 15.86 Favored Glycine 0 N--CA 1.421 -2.312 0 N-CA-C 109.928 -1.269 . . . . 0.0 109.928 177.583 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -86.94 -87.79 1.06 Allowed Glycine 0 C--N 1.295 -1.731 0 C-N-CA 119.872 -1.156 . . . . 0.0 110.692 179.316 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.493 ' O ' ' HG3' ' A' ' 24' ' ' ARG . 39.0 mt-10 -67.96 -37.17 81.24 Favored 'General case' 0 C--N 1.311 -1.069 0 CA-C-N 115.317 -0.441 . . . . 0.0 110.929 -179.234 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.456 ' CD ' ' H ' ' A' ' 21' ' ' GLU . 1.8 mp0 -54.95 -42.18 72.0 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 123.648 0.592 . . . . 0.0 110.394 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 51.7 tt0 -71.55 -38.62 70.98 Favored 'General case' 0 N--CA 1.431 -1.392 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.727 -177.628 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 44.0 ttp180 -68.09 -33.94 75.46 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.161 0.505 . . . . 0.0 109.966 178.09 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.493 ' HG3' ' O ' ' A' ' 20' ' ' GLU . 91.8 mtt180 -65.48 -54.48 27.7 Favored 'General case' 0 CA--C 1.516 -0.362 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.595 177.04 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 1.8 m -58.02 -37.27 74.01 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.493 0.553 . . . . 0.0 112.493 176.496 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 53.0 tp60 -59.01 -51.55 69.6 Favored 'General case' 0 N--CA 1.448 -0.557 0 N-CA-C 110.283 -0.266 . . . . 0.0 110.283 177.062 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 tt0 -63.4 -46.73 85.06 Favored 'General case' 0 N--CA 1.45 -0.456 0 CA-C-N 116.122 -0.49 . . . . 0.0 110.824 -179.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.483 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 32.7 mm-40 -55.22 -47.52 75.2 Favored 'General case' 0 C--O 1.217 -0.612 0 O-C-N 123.59 0.556 . . . . 0.0 110.645 178.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.7 t -59.45 -44.18 93.0 Favored 'General case' 0 C--N 1.315 -0.896 0 CA-C-N 116.167 -0.47 . . . . 0.0 110.584 -178.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -67.12 -40.14 86.78 Favored 'General case' 0 C--O 1.218 -0.565 0 N-CA-C 111.779 0.289 . . . . 0.0 111.779 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -74.89 -30.58 61.34 Favored 'General case' 0 C--N 1.324 -0.541 0 N-CA-C 112.923 0.712 . . . . 0.0 112.923 -177.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.483 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 91.5 mtt180 -73.2 -43.62 61.04 Favored 'General case' 0 CA--C 1.502 -0.867 0 N-CA-C 109.646 -0.502 . . . . 0.0 109.646 177.789 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.1 tp -64.39 -48.18 76.39 Favored 'General case' 0 C--N 1.315 -0.929 0 CA-C-N 115.068 -0.969 . . . . 0.0 109.081 176.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 37.7 ttm180 51.62 77.63 0.14 Allowed 'General case' 0 N--CA 1.446 -0.673 0 C-N-CA 125.116 1.366 . . . . 0.0 111.489 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 19.6 t70 . . . . . 0 C--N 1.288 -2.099 0 CA-C-N 113.494 -1.685 . . . . 0.0 107.929 -178.937 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.172 0 CA-C-O 120.784 0.326 . . . . 0.0 111.477 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -65.02 -29.45 70.36 Favored 'General case' 0 C--N 1.319 -0.758 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -177.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -69.16 -30.08 68.24 Favored 'General case' 0 C--O 1.217 -0.637 0 CA-C-O 121.641 0.734 . . . . 0.0 110.015 176.775 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.422 ' O ' ' HB3' ' A' ' 7' ' ' CYS . 26.4 m -78.35 -32.95 49.32 Favored 'General case' 0 C--N 1.301 -1.535 0 CA-C-N 114.953 -1.021 . . . . 0.0 109.234 177.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.51 ' HG2' ' NE2' ' A' ' 9' ' ' GLN . 36.2 tt0 -63.1 -52.24 63.42 Favored 'General case' 0 N--CA 1.447 -0.613 0 CA-C-N 115.464 -0.789 . . . . 0.0 109.799 178.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 11.8 pt -66.17 -33.87 66.4 Favored 'Isoleucine or valine' 0 CA--C 1.507 -0.697 0 C-N-CA 120.27 -0.572 . . . . 0.0 111.237 176.351 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.422 ' HB3' ' O ' ' A' ' 4' ' ' THR . 38.1 t -52.45 -47.58 66.35 Favored 'General case' 0 C--O 1.245 0.823 0 O-C-N 123.88 0.738 . . . . 0.0 111.041 177.368 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 9.8 tpt180 -78.39 -41.85 32.0 Favored 'General case' 0 N--CA 1.437 -1.101 0 C-N-CA 119.952 -0.699 . . . . 0.0 111.369 178.164 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.51 ' NE2' ' HG2' ' A' ' 5' ' ' GLU . 49.6 mt-30 -56.96 -41.25 78.0 Favored 'General case' 0 N--CA 1.476 0.872 0 N-CA-C 112.02 0.378 . . . . 0.0 112.02 -179.219 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 16.4 t90 -59.02 -51.6 69.38 Favored 'General case' 0 N--CA 1.443 -0.779 0 O-C-N 123.757 0.661 . . . . 0.0 109.263 -179.831 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 96.9 m -64.31 -39.58 94.19 Favored 'General case' 0 C--O 1.216 -0.687 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.369 178.62 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 -60.46 -45.4 93.84 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 121.057 0.456 . . . . 0.0 111.217 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 88.0 t -77.0 -45.86 30.0 Favored 'Isoleucine or valine' 0 C--N 1.313 -0.994 0 CA-C-N 116.245 -0.434 . . . . 0.0 111.401 -178.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 16.3 tpt -70.02 -49.49 50.81 Favored 'General case' 0 C--N 1.324 -0.513 0 CA-C-N 116.335 -0.393 . . . . 0.0 111.869 -175.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.465 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 16.5 ptpt -130.56 79.7 71.63 Favored Pre-proline 0 C--N 1.308 -1.216 0 CA-C-O 121.734 0.778 . . . . 0.0 112.015 -175.111 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -82.94 120.66 3.06 Favored 'Trans proline' 0 N--CA 1.445 -1.338 0 C-N-CA 122.87 2.38 . . . . 0.0 111.732 -177.899 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 9.7 tt0 69.23 99.95 0.06 Allowed 'General case' 0 C--O 1.241 0.623 0 C-N-CA 124.989 1.316 . . . . 0.0 111.735 -179.794 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -158.82 167.77 34.82 Favored Glycine 0 N--CA 1.432 -1.572 0 N-CA-C 109.78 -1.328 . . . . 0.0 109.78 178.659 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -94.02 -90.95 1.63 Allowed Glycine 0 N--CA 1.431 -1.692 0 C-N-CA 120.382 -0.914 . . . . 0.0 111.384 -178.184 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 49.9 mm-40 -64.42 -31.45 72.67 Favored 'General case' 0 C--O 1.214 -0.799 0 C-N-CA 122.33 0.252 . . . . 0.0 111.667 -178.601 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.465 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 67.5 mm-40 -60.88 -50.81 71.93 Favored 'General case' 0 C--O 1.241 0.649 0 CA-C-O 120.809 0.338 . . . . 0.0 111.573 178.104 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -75.18 -32.86 61.37 Favored 'General case' 0 C--N 1.317 -0.814 0 CA-C-O 120.967 0.413 . . . . 0.0 109.933 -178.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 68.7 ttt180 -62.03 -42.03 98.73 Favored 'General case' 0 C--N 1.325 -0.466 0 CA-C-O 121.318 0.58 . . . . 0.0 109.595 178.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.4 ttm180 -63.35 -44.12 95.74 Favored 'General case' 0 N--CA 1.442 -0.843 0 CA-C-N 115.054 -0.975 . . . . 0.0 108.826 178.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 28.7 m -55.95 -47.12 78.18 Favored 'General case' 0 N--CA 1.465 0.299 0 O-C-N 123.454 0.471 . . . . 0.0 110.781 174.513 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 79.0 mt-30 -55.21 -56.67 17.32 Favored 'General case' 0 N--CA 1.467 0.393 0 O-C-N 123.52 0.513 . . . . 0.0 111.082 178.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -60.81 -46.72 89.41 Favored 'General case' 0 C--N 1.323 -0.584 0 CA-C-N 116.011 -0.54 . . . . 0.0 112.356 -176.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -63.14 -41.44 99.29 Favored 'General case' 0 C--N 1.324 -0.536 0 CA-C-O 121.208 0.527 . . . . 0.0 110.445 179.519 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.49 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.4 t -65.68 -45.35 83.17 Favored 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 115.524 -0.762 . . . . 0.0 110.09 -177.709 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -72.66 -27.97 62.43 Favored 'General case' 0 N--CA 1.446 -0.645 0 CA-C-N 115.986 -0.552 . . . . 0.0 112.207 -179.092 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -71.67 -36.39 70.63 Favored 'General case' 0 C--N 1.325 -0.467 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 176.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 66.1 ttt180 -70.28 -38.02 74.97 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.047 -0.524 . . . . 0.0 109.7 175.55 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.2 tp -58.13 -40.12 80.47 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.131 -0.94 . . . . 0.0 110.692 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 90.5 mtm180 59.66 71.68 0.57 Allowed 'General case' 0 C--O 1.242 0.662 0 O-C-N 124.141 0.901 . . . . 0.0 110.75 179.011 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.1 t70 . . . . . 0 C--N 1.299 -1.59 0 CA-C-N 115.043 -0.98 . . . . 0.0 109.609 -176.187 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.247 0.949 0 CA-C-O 120.933 0.397 . . . . 0.0 110.503 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 97.9 mttt -62.24 -40.31 95.75 Favored 'General case' 0 CA--C 1.506 -0.736 0 N-CA-C 113.659 0.985 . . . . 0.0 113.659 -176.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -66.65 -30.62 70.93 Favored 'General case' 0 C--N 1.316 -0.85 0 CA-C-O 121.345 0.593 . . . . 0.0 110.059 -177.328 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 28.4 m -69.78 -36.55 75.83 Favored 'General case' 0 C--N 1.304 -1.386 0 CA-C-N 115.432 -0.804 . . . . 0.0 109.561 176.649 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -64.59 -50.49 67.01 Favored 'General case' 0 C--O 1.219 -0.511 0 CA-C-N 115.883 -0.599 . . . . 0.0 109.835 178.07 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 57.8 mt -61.34 -50.42 80.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 CA-C-N 115.902 -0.59 . . . . 0.0 109.932 179.789 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 35.9 t -50.47 -44.47 55.72 Favored 'General case' 0 C--O 1.246 0.875 0 CA-C-N 115.345 -0.843 . . . . 0.0 111.201 179.124 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 15.3 tpt180 -74.62 -48.82 24.25 Favored 'General case' 0 C--O 1.217 -0.628 0 CA-C-N 116.62 -0.264 . . . . 0.0 110.975 177.731 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -54.7 -39.5 68.22 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.321 0.648 . . . . 0.0 111.99 -176.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 77.9 t90 -55.07 -52.97 61.52 Favored 'General case' 0 C--N 1.322 -0.606 0 O-C-N 123.78 0.675 . . . . 0.0 110.182 179.285 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.8 m -75.94 -32.21 59.45 Favored 'General case' 0 C--N 1.317 -0.838 0 N-CA-C 112.459 0.541 . . . . 0.0 112.459 178.687 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 49.0 tt0 -56.63 -46.71 80.81 Favored 'General case' 0 C--O 1.222 -0.394 0 C-N-CA 123.623 0.769 . . . . 0.0 110.602 179.839 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -86.01 -38.9 13.16 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.919 0 CA-C-N 115.863 -0.608 . . . . 0.0 111.403 -177.125 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 15.1 tpt -62.23 -40.4 96.02 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-O 120.804 0.335 . . . . 0.0 111.624 -177.747 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -127.3 108.84 21.31 Favored Pre-proline 0 C--N 1.304 -1.378 0 CA-C-N 116.414 -0.357 . . . . 0.0 110.075 178.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -54.91 158.59 10.85 Favored 'Trans proline' 0 C--O 1.25 1.101 0 C-N-CA 122.938 2.425 . . . . 0.0 111.261 178.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 52.2 mm-40 -63.81 112.51 2.92 Favored 'General case' 0 C--N 1.306 -1.297 0 CA-C-N 115.946 -0.57 . . . . 0.0 111.505 -172.176 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -128.67 -91.96 0.69 Allowed Glycine 0 N--CA 1.426 -1.968 0 N-CA-C 109.493 -1.443 . . . . 0.0 109.493 178.383 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -163.03 -80.47 0.04 OUTLIER Glycine 0 C--N 1.302 -1.346 0 C-N-CA 120.274 -0.965 . . . . 0.0 112.936 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 3.7 mp0 -57.52 -39.65 77.02 Favored 'General case' 0 CA--C 1.506 -0.74 0 C-N-CA 123.061 0.545 . . . . 0.0 110.769 -176.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.438 ' H ' ' CD ' ' A' ' 21' ' ' GLU . 1.3 mp0 -50.42 -54.95 18.13 Favored 'General case' 0 C--N 1.312 -1.026 0 C-N-CA 124.632 1.173 . . . . 0.0 110.304 178.324 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 24.1 mp0 -67.83 -37.98 82.62 Favored 'General case' 0 N--CA 1.442 -0.866 0 CA-C-N 115.415 -0.811 . . . . 0.0 111.531 -178.741 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 29.9 tpt180 -61.24 -47.49 85.83 Favored 'General case' 0 N--CA 1.447 -0.624 0 N-CA-C 110.192 -0.299 . . . . 0.0 110.192 177.296 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -63.34 -46.67 85.53 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 116.342 -0.39 . . . . 0.0 110.004 178.342 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.2 m -62.25 -31.81 72.42 Favored 'General case' 0 C--N 1.317 -0.81 0 N-CA-C 113.357 0.873 . . . . 0.0 113.357 178.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 22.1 tm0? -66.67 -43.75 83.65 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 177.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 25.1 mt-30 -64.59 -48.71 73.94 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.087 178.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.416 ' O ' ' HG3' ' A' ' 32' ' ' ARG . 60.3 mm-40 -59.46 -43.72 93.13 Favored 'General case' 0 CA--C 1.519 -0.221 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.958 177.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 49.0 t -59.6 -57.82 11.26 Favored 'General case' 0 C--O 1.212 -0.891 0 O-C-N 123.492 0.495 . . . . 0.0 110.74 -178.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 66.2 mm-40 -57.7 -39.93 78.32 Favored 'General case' 0 N--CA 1.47 0.56 0 N-CA-C 112.203 0.446 . . . . 0.0 112.203 -178.568 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 7.0 tp10 -60.57 -43.31 97.44 Favored 'General case' 0 C--N 1.32 -0.706 0 CA-C-N 115.685 -0.689 . . . . 0.0 110.647 -178.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.416 ' HG3' ' O ' ' A' ' 28' ' ' GLU . 51.0 mtt180 -89.42 -28.69 19.56 Favored 'General case' 0 C--N 1.322 -0.604 0 CA-C-N 116.059 -0.519 . . . . 0.0 111.656 -175.762 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 54.2 tp -71.7 -36.73 70.66 Favored 'General case' 0 C--N 1.308 -1.22 0 CA-C-N 115.652 -0.704 . . . . 0.0 110.168 -179.779 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 5.9 tpp180 -91.98 82.35 5.12 Favored 'General case' 0 N--CA 1.429 -1.524 0 N-CA-C 108.182 -1.044 . . . . 0.0 108.182 -179.548 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.2 t70 . . . . . 0 C--N 1.292 -1.897 0 CA-C-N 115.763 -0.653 . . . . 0.0 109.325 -177.965 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . 0.485 ' O ' ' HG2' ' A' ' 5' ' ' GLU . . . . . . . . 0 CA--C 1.507 -0.681 0 CA-C-O 121.249 0.547 . . . . 0.0 110.409 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -60.96 -45.78 93.35 Favored 'General case' 0 C--N 1.319 -0.719 0 CA-C-N 115.111 -0.949 . . . . 0.0 111.261 -176.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -66.52 -31.45 72.18 Favored 'General case' 0 C--N 1.312 -1.025 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.975 -178.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.0 m -72.07 -36.46 69.56 Favored 'General case' 0 C--N 1.301 -1.532 0 CA-C-N 115.708 -0.678 . . . . 0.0 109.821 178.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 1' ' ' PCA . 16.8 mm-40 -67.69 -52.93 32.02 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 115.95 -0.568 . . . . 0.0 111.645 179.768 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 1.9 mp -65.54 -38.07 81.53 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 109.935 -0.394 . . . . 0.0 109.935 -179.353 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 52.3 t -58.74 -42.94 89.97 Favored 'General case' 0 C--O 1.245 0.829 0 CA-C-N 115.605 -0.725 . . . . 0.0 110.877 178.498 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.42 HH11 ' HD3' ' A' ' 8' ' ' ARG . 8.6 tpt180 -75.71 -45.24 37.82 Favored 'General case' 0 N--CA 1.438 -1.057 0 C-N-CA 120.096 -0.641 . . . . 0.0 110.909 178.415 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -62.74 -31.83 72.84 Favored 'General case' 0 C--N 1.325 -0.476 0 N-CA-C 113.175 0.805 . . . . 0.0 113.175 -176.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 91.0 t90 -59.85 -49.17 78.75 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 109.363 -0.606 . . . . 0.0 109.363 175.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 70.2 m -66.67 -43.57 84.14 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.762 177.279 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -59.29 -42.41 91.21 Favored 'General case' 0 N--CA 1.451 -0.389 0 CA-C-N 115.554 -0.748 . . . . 0.0 111.968 -176.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 22.7 m -86.11 -19.64 8.28 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.664 0 C-N-CA 119.883 -0.727 . . . . 0.0 111.35 -179.504 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.2 ttt -75.08 -47.94 26.34 Favored 'General case' 0 C--N 1.328 -0.353 0 C-N-CA 120.865 -0.334 . . . . 0.0 110.307 179.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 61.0 tttp -156.37 99.07 2.12 Favored Pre-proline 0 N--CA 1.438 -1.059 0 C-N-CA 120.798 -0.361 . . . . 0.0 111.123 179.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -85.66 120.08 2.01 Favored 'Trans proline' 0 N--CA 1.451 -1.02 0 C-N-CA 122.609 2.206 . . . . 0.0 110.549 176.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 8.2 tp-100 -164.59 -51.6 0.03 OUTLIER 'General case' 0 C--N 1.308 -1.23 0 CA-C-O 121.31 0.576 . . . . 0.0 110.635 -179.653 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.47 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 105.49 -137.06 13.54 Favored Glycine 0 N--CA 1.416 -2.658 0 N-CA-C 108.588 -1.805 . . . . 0.0 108.588 -174.859 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.551 ' O ' ' HG2' ' A' ' 23' ' ' ARG . . . 55.58 -135.99 47.65 Favored Glycine 0 C--O 1.246 0.898 0 O-C-N 123.934 0.432 . . . . 0.0 113.71 175.352 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -73.37 -30.11 63.07 Favored 'General case' 0 C--N 1.316 -0.866 0 C-N-CA 122.693 0.397 . . . . 0.0 110.591 -177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 21.2 tp10 -58.92 -43.85 91.19 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-O 121.954 0.883 . . . . 0.0 108.717 179.336 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.47 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 9.6 tt0 -69.96 -39.02 76.26 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.849 -1.069 . . . . 0.0 110.45 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.551 ' HG2' ' O ' ' A' ' 19' ' ' GLY . 30.9 mmm180 -61.8 -44.18 97.37 Favored 'General case' 0 N--CA 1.468 0.451 0 N-CA-C 109.559 -0.534 . . . . 0.0 109.559 -179.673 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 34.9 mmt180 -61.65 -49.67 75.6 Favored 'General case' 0 CA--C 1.509 -0.606 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.529 178.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.434 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 24.6 m -62.13 -37.31 84.67 Favored 'General case' 0 C--O 1.209 -1.05 0 N-CA-C 112.196 0.443 . . . . 0.0 112.196 177.202 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 33.4 tt0 -57.67 -52.98 63.2 Favored 'General case' 0 C--O 1.245 0.821 0 C-N-CA 122.935 0.494 . . . . 0.0 110.5 177.264 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 68.1 mt-30 -55.56 -58.86 6.05 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 115.147 -0.933 . . . . 0.0 111.486 -179.503 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.452 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.8 pt-20 -66.68 -33.69 76.21 Favored 'General case' 0 C--N 1.32 -0.712 0 CA-C-N 115.959 -0.564 . . . . 0.0 112.273 -175.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 10.1 t -65.54 -52.53 51.74 Favored 'General case' 0 C--N 1.324 -0.5 0 CA-C-O 120.365 0.126 . . . . 0.0 110.704 -177.471 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -72.39 -25.93 61.69 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 113.344 0.868 . . . . 0.0 113.344 -177.094 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -72.38 -42.68 64.94 Favored 'General case' 0 C--N 1.318 -0.782 0 N-CA-C 109.24 -0.652 . . . . 0.0 109.24 178.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 74.3 ttt180 -67.94 -37.76 82.0 Favored 'General case' 0 C--N 1.317 -0.809 0 CA-C-N 115.223 -0.898 . . . . 0.0 110.119 177.744 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 47.5 tp -69.91 -33.65 72.46 Favored 'General case' 0 C--N 1.31 -1.148 0 CA-C-N 115.588 -0.733 . . . . 0.0 110.766 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 53.6 ttp180 -69.35 106.39 2.9 Favored 'General case' 0 N--CA 1.447 -0.591 0 CA-C-O 121.36 0.6 . . . . 0.0 110.055 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 24.6 t70 . . . . . 0 C--N 1.286 -2.189 0 N-CA-C 107.157 -1.423 . . . . 0.0 107.157 179.175 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.225 -0.198 0 CA-C-O 121.494 0.664 . . . . 0.0 110.452 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 74.8 mmtt -68.59 -36.48 78.77 Favored 'General case' 0 C--N 1.315 -0.915 0 CA-C-N 115.507 -0.769 . . . . 0.0 111.426 -175.792 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -73.73 -27.35 61.14 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-O 121.598 0.713 . . . . 0.0 110.974 178.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 2.8 m -74.7 -33.49 62.44 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-N 114.901 -1.045 . . . . 0.0 108.796 178.142 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.9 tp10 -62.63 -47.74 82.4 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.04 176.949 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.5 mt -61.7 -47.85 91.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 CA-C-N 115.783 -0.644 . . . . 0.0 109.572 176.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 49.5 t -46.98 -46.58 21.73 Favored 'General case' 0 CA--C 1.546 0.827 0 CA-C-N 114.719 -1.128 . . . . 0.0 111.944 178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 23.9 tpt180 -70.22 -45.67 66.07 Favored 'General case' 0 C--O 1.221 -0.445 0 C-N-CA 119.948 -0.701 . . . . 0.0 111.38 176.082 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -56.0 -35.15 66.48 Favored 'General case' 0 CA--C 1.544 0.713 0 O-C-N 123.288 0.367 . . . . 0.0 111.818 -177.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.1 t90 -60.97 -55.41 33.29 Favored 'General case' 0 C--O 1.242 0.698 0 CA-C-O 121.071 0.462 . . . . 0.0 110.035 176.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 58.4 m -68.25 -32.56 72.84 Favored 'General case' 0 C--N 1.317 -0.843 0 CA-C-N 115.94 -0.573 . . . . 0.0 112.518 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 64.8 tt0 -57.28 -48.82 77.91 Favored 'General case' 0 C--N 1.316 -0.873 0 C-N-CA 123.554 0.742 . . . . 0.0 110.631 -179.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 78.7 t -79.53 -39.63 20.69 Favored 'Isoleucine or valine' 0 C--N 1.317 -0.821 0 CA-C-N 115.321 -0.854 . . . . 0.0 112.268 -176.498 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 60.0 mtt -84.0 -27.51 28.36 Favored 'General case' 0 C--N 1.321 -0.65 0 N-CA-C 114.08 1.141 . . . . 0.0 114.08 -175.871 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.476 ' CG ' ' HB3' ' A' ' 21' ' ' GLU . 4.7 mptp? -108.91 107.35 59.96 Favored Pre-proline 0 C--N 1.308 -1.231 0 O-C-N 122.249 -0.282 . . . . 0.0 110.296 -177.241 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_exo -64.56 121.19 8.68 Favored 'Trans proline' 0 C--O 1.251 1.147 0 C-N-CA 123.507 2.805 . . . . 0.0 113.335 -178.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 87.3 mm-40 68.3 -66.72 0.22 Allowed 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 125.474 1.51 . . . . 0.0 113.004 177.15 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.43 ' HA2' ' HB2' ' A' ' 22' ' ' GLN . . . 155.2 -120.95 1.05 Allowed Glycine 0 N--CA 1.424 -2.128 0 C-N-CA 120.915 -0.66 . . . . 0.0 112.783 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 79.6 -143.98 26.25 Favored Glycine 0 N--CA 1.445 -0.762 0 N-CA-C 110.372 -1.091 . . . . 0.0 110.372 -177.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -56.2 -32.5 64.44 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 121.019 0.438 . . . . 0.0 111.214 177.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.476 ' HB3' ' CG ' ' A' ' 15' ' ' LYS . 33.1 mm-40 -61.61 -40.69 95.71 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-N 115.67 -0.696 . . . . 0.0 110.672 177.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.43 ' HB2' ' HA2' ' A' ' 18' ' ' GLY . 36.1 tt0 -76.78 -34.45 58.0 Favored 'General case' 0 C--N 1.316 -0.866 0 CA-C-N 115.761 -0.654 . . . . 0.0 109.594 -178.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 94.5 mtt180 -61.71 -50.64 71.62 Favored 'General case' 0 C--O 1.241 0.623 0 CA-C-N 115.691 -0.686 . . . . 0.0 109.249 176.874 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 39.8 ttt180 -59.9 -45.76 91.49 Favored 'General case' 0 N--CA 1.45 -0.459 0 CA-C-N 115.386 -0.824 . . . . 0.0 110.158 177.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.482 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 31.5 m -59.27 -39.8 84.06 Favored 'General case' 0 N--CA 1.444 -0.737 0 N-CA-C 113.512 0.93 . . . . 0.0 113.512 179.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.466 ' O ' ' HG3' ' A' ' 30' ' ' GLU . 50.1 tt0 -62.29 -49.17 76.71 Favored 'General case' 0 CA--C 1.511 -0.532 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 176.781 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 34.9 tt0 -55.02 -52.48 63.02 Favored 'General case' 0 C--N 1.323 -0.571 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.766 -179.793 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -68.21 -29.03 67.77 Favored 'General case' 0 C--N 1.317 -0.817 0 N-CA-C 112.029 0.381 . . . . 0.0 112.029 -179.223 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.482 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 3.3 t -71.94 -43.56 65.05 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 108.861 -0.792 . . . . 0.0 108.861 -179.666 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.466 ' HG3' ' O ' ' A' ' 26' ' ' GLN . 58.8 mt-10 -68.79 -32.65 72.53 Favored 'General case' 0 C--O 1.216 -0.667 0 N-CA-C 109.479 -0.563 . . . . 0.0 109.479 178.083 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 8.6 tp10 -67.66 -38.34 83.64 Favored 'General case' 0 C--N 1.322 -0.593 0 CA-C-O 121.657 0.741 . . . . 0.0 109.528 177.603 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 7.1 tpm_? -79.04 -34.05 44.18 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.528 -0.76 . . . . 0.0 110.961 -178.33 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 52.9 tp -74.12 -32.01 63.01 Favored 'General case' 0 C--N 1.311 -1.102 0 N-CA-C 109.205 -0.665 . . . . 0.0 109.205 176.286 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 48.6 ttp180 69.05 -77.08 0.05 Allowed 'General case' 0 C--O 1.237 0.44 0 C-N-CA 125.714 1.606 . . . . 0.0 111.313 178.248 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 21.1 t70 . . . . . 0 CA--C 1.488 -1.408 0 C-N-CA 125.346 1.459 . . . . 0.0 107.902 -174.501 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.468 0 CA-C-O 121.47 0.652 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.506 ' O ' HG13 ' A' ' 6' ' ' ILE . 67.0 mttm -69.38 -16.61 63.55 Favored 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 114.329 1.233 . . . . 0.0 114.329 -175.375 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -68.57 -40.2 80.66 Favored 'General case' 0 C--O 1.246 0.873 0 CA-C-O 121.635 0.731 . . . . 0.0 109.628 175.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 8.8 m -75.07 -32.6 61.54 Favored 'General case' 0 C--N 1.291 -1.939 0 CA-C-N 114.383 -1.281 . . . . 0.0 108.886 178.493 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -58.94 -52.1 67.19 Favored 'General case' 0 N--CA 1.455 -0.214 0 CA-C-N 115.226 -0.897 . . . . 0.0 110.103 177.14 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.506 HG13 ' O ' ' A' ' 2' ' ' LYS . 72.6 mt -57.93 -48.14 84.74 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.059 0 N-CA-C 109.206 -0.665 . . . . 0.0 109.206 178.325 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 34.4 t -49.44 -53.8 20.97 Favored 'General case' 0 C--O 1.248 0.991 0 CA-C-N 114.148 -1.387 . . . . 0.0 111.916 177.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 0.9 OUTLIER -72.05 -37.98 69.58 Favored 'General case' 0 C--O 1.211 -0.936 0 C-N-CA 120.87 -0.332 . . . . 0.0 110.453 179.772 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 59.1 tp60 -56.12 -41.21 74.92 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 122.866 0.466 . . . . 0.0 110.302 -179.261 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 83.8 t90 -60.76 -46.61 89.8 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-N 115.649 -0.705 . . . . 0.0 109.793 178.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 67.7 m -71.26 -30.61 66.51 Favored 'General case' 0 C--O 1.205 -1.279 0 N-CA-C 112.426 0.528 . . . . 0.0 112.426 179.226 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -64.91 -32.34 74.0 Favored 'General case' 0 C--N 1.317 -0.826 0 CA-C-O 121.672 0.748 . . . . 0.0 109.929 177.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.4 t -85.71 -46.65 16.96 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.925 0 CA-C-N 115.797 -0.638 . . . . 0.0 110.762 178.808 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 26.4 mmt -74.42 -39.29 62.71 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 113.283 0.846 . . . . 0.0 113.283 -176.567 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.471 ' HD3' ' HB3' ' A' ' 21' ' ' GLU . 64.7 mttm -131.3 74.61 78.78 Favored Pre-proline 0 CA--C 1.55 0.948 0 C-N-CA 122.872 0.469 . . . . 0.0 109.905 -177.437 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -87.58 120.18 1.44 Allowed 'Trans proline' 0 N--CA 1.454 -0.833 0 C-N-CA 122.688 2.259 . . . . 0.0 112.514 -176.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.2 mm-40 63.82 -176.6 0.16 Allowed 'General case' 0 C--O 1.239 0.503 0 C-N-CA 124.454 1.102 . . . . 0.0 111.655 177.999 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 111.65 -97.41 0.93 Allowed Glycine 0 C--N 1.29 -1.986 0 N-CA-C 110.771 -0.932 . . . . 0.0 110.771 177.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . 0.489 ' O ' ' HG3' ' A' ' 23' ' ' ARG . . . 176.5 -91.6 0.08 OUTLIER Glycine 0 N--CA 1.426 -1.998 0 C-N-CA 120.731 -0.747 . . . . 0.0 112.298 178.317 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.88 -45.09 70.96 Favored 'General case' 0 C--N 1.319 -0.752 0 N-CA-C 114.652 1.353 . . . . 0.0 114.652 -173.164 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.471 ' HB3' ' HD3' ' A' ' 15' ' ' LYS . 28.4 mm-40 -67.72 -35.57 79.01 Favored 'General case' 0 C--N 1.31 -1.119 0 CA-C-O 121.048 0.451 . . . . 0.0 111.415 -178.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 29.6 tt0 -71.62 -38.93 70.74 Favored 'General case' 0 C--N 1.308 -1.2 0 CA-C-N 115.579 -0.737 . . . . 0.0 109.158 178.57 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.489 ' HG3' ' O ' ' A' ' 19' ' ' GLY . 73.7 mtp180 -61.26 -42.79 99.23 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 115.479 -0.782 . . . . 0.0 109.966 176.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 38.2 mtm180 -61.83 -42.55 99.17 Favored 'General case' 0 N--CA 1.448 -0.556 0 CA-C-N 116.243 -0.435 . . . . 0.0 111.288 178.548 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.439 ' SG ' ' HD2' ' A' ' 15' ' ' LYS . 1.8 m -64.74 -34.92 79.45 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 177.048 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.438 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 34.8 tt0 -63.31 -50.6 69.4 Favored 'General case' 0 N--CA 1.444 -0.751 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 178.398 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -60.12 -49.31 78.15 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 115.304 -0.862 . . . . 0.0 109.975 178.384 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -53.01 -49.44 66.22 Favored 'General case' 0 CA--C 1.498 -1.034 0 C-N-CA 123.891 0.876 . . . . 0.0 112.881 179.278 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 5.9 t -68.0 -34.48 76.6 Favored 'General case' 0 C--N 1.308 -1.225 0 O-C-N 123.55 0.531 . . . . 0.0 110.607 -175.676 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 12.2 mm-40 -68.85 -38.96 80.14 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 116.526 -0.306 . . . . 0.0 110.792 178.862 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -76.13 -18.76 59.0 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 120.989 0.423 . . . . 0.0 110.991 178.371 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 34.7 ttm180 -85.55 -54.58 4.47 Favored 'General case' 0 C--N 1.311 -1.082 0 CA-C-N 116.086 -0.506 . . . . 0.0 111.199 -176.482 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -85.67 -33.85 21.46 Favored 'General case' 0 C--N 1.317 -0.841 0 C-N-CA 120.387 -0.525 . . . . 0.0 111.706 -178.26 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 97.9 mtt180 60.42 93.73 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 N-CA-C 114.13 1.159 . . . . 0.0 114.13 176.145 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 36.8 t70 . . . . . 0 C--N 1.291 -1.946 0 N-CA-C 108.286 -1.005 . . . . 0.0 108.286 176.02 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.236 0.373 0 CA-C-O 121.562 0.696 . . . . 0.0 110.575 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.469 ' O ' ' HB3' ' A' ' 5' ' ' GLU . 74.0 mmtt -80.86 -32.27 35.08 Favored 'General case' 0 N--CA 1.44 -0.93 0 CA-C-N 115.535 -0.757 . . . . 0.0 111.901 -177.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 40.9 mt-10 -78.48 -26.62 46.08 Favored 'General case' 0 C--N 1.306 -1.298 0 C-N-CA 119.585 -0.846 . . . . 0.0 110.124 179.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.6 m -72.27 -32.34 66.55 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 114.798 -1.092 . . . . 0.0 108.397 175.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.469 ' HB3' ' O ' ' A' ' 2' ' ' LYS . 13.3 tp10 -62.06 -52.15 65.08 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-N 115.144 -0.934 . . . . 0.0 108.875 175.743 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . 0.456 HG13 ' O ' ' A' ' 2' ' ' LYS . 61.2 mt -58.01 -50.41 78.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.72 0 CA-C-O 121.396 0.617 . . . . 0.0 109.553 178.388 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.0 t -54.12 -48.17 71.04 Favored 'General case' 0 C--N 1.313 -1.004 0 CA-C-N 114.423 -1.262 . . . . 0.0 112.346 -179.833 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -69.92 -39.24 76.26 Favored 'General case' 0 N--CA 1.45 -0.463 0 C-N-CA 120.173 -0.611 . . . . 0.0 111.099 178.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 76.9 mt-30 -58.38 -38.62 77.67 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 111.787 0.292 . . . . 0.0 111.787 178.018 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . 0.413 ' HE3' ' SG ' ' A' ' 11' ' ' CYS . 82.9 t90 -59.18 -55.06 39.76 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 109.079 -0.711 . . . . 0.0 109.079 177.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.413 ' SG ' ' HE3' ' A' ' 10' ' ' TRP . 96.4 m -67.41 -34.07 76.48 Favored 'General case' 0 C--N 1.314 -0.952 0 N-CA-C 113.143 0.794 . . . . 0.0 113.143 -178.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 6.1 tp-100 -58.8 -45.88 88.87 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-O 121.031 0.443 . . . . 0.0 110.597 178.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 12.8 p -82.17 -35.16 12.89 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.673 0 C-N-CA 120.368 -0.533 . . . . 0.0 111.178 -178.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 14.5 tpt -70.52 -47.94 57.96 Favored 'General case' 0 C--N 1.326 -0.421 0 CA-C-N 116.275 -0.421 . . . . 0.0 111.008 -177.69 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 46.0 mmtm -126.79 96.09 35.96 Favored Pre-proline 0 C--N 1.312 -1.037 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.353 -179.26 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 28.5 Cg_exo -64.51 141.17 72.53 Favored 'Trans proline' 0 C--O 1.244 0.792 0 C-N-CA 122.157 1.905 . . . . 0.0 110.061 177.369 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 74.7 mt-30 75.67 -53.44 0.63 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 125.417 1.487 . . . . 0.0 110.758 -176.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 102.6 -78.79 0.33 Allowed Glycine 0 N--CA 1.43 -1.766 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.213 178.31 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.05 -119.22 12.71 Favored Glycine 0 C--N 1.307 -1.083 0 N-CA-C 112.058 -0.417 . . . . 0.0 112.058 -179.587 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -66.85 -34.13 77.12 Favored 'General case' 0 C--N 1.31 -1.152 0 CA-C-O 121.79 0.805 . . . . 0.0 109.036 177.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -74.66 -18.53 60.52 Favored 'General case' 0 N--CA 1.434 -1.259 0 CA-C-N 115.192 -0.913 . . . . 0.0 110.646 178.366 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.439 HE22 ' NE2' ' A' ' 26' ' ' GLN . 18.7 tm0? -67.4 -45.53 75.88 Favored 'General case' 0 CA--C 1.501 -0.922 0 N-CA-C 106.578 -1.638 . . . . 0.0 106.578 174.201 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.412 HH11 ' HD2' ' A' ' 23' ' ' ARG . 17.6 mmm180 -59.81 -48.98 79.51 Favored 'General case' 0 CA--C 1.516 -0.35 0 O-C-N 124.152 0.908 . . . . 0.0 109.584 178.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . 0.555 ' O ' ' HG2' ' A' ' 28' ' ' GLU . 71.7 ttt180 -57.66 -56.87 16.35 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.126 -0.943 . . . . 0.0 110.482 177.884 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.518 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 10.7 m -57.36 -44.58 84.48 Favored 'General case' 0 C--O 1.204 -1.293 0 N-CA-C 113.679 0.992 . . . . 0.0 113.679 -179.392 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.439 ' NE2' HE22 ' A' ' 22' ' ' GLN . 36.0 tt0 -63.47 -40.66 97.71 Favored 'General case' 0 C--N 1.317 -0.811 0 N-CA-C 109.85 -0.426 . . . . 0.0 109.85 -179.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 23.1 tp60 -64.65 -44.65 89.77 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-N 115.733 -0.667 . . . . 0.0 110.564 179.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . 0.555 ' HG2' ' O ' ' A' ' 24' ' ' ARG . 12.0 mm-40 -71.77 -29.52 64.57 Favored 'General case' 0 C--N 1.314 -0.972 0 CA-C-O 121.071 0.462 . . . . 0.0 110.066 179.316 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.518 ' HB2' ' O ' ' A' ' 25' ' ' CYS . 2.2 t -69.6 -47.6 62.96 Favored 'General case' 0 C--N 1.312 -1.057 0 CA-C-N 115.915 -0.584 . . . . 0.0 110.079 -177.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 10.0 pt-20 -67.26 -27.3 67.08 Favored 'General case' 0 CA--C 1.534 0.362 0 CA-C-O 120.988 0.423 . . . . 0.0 110.618 177.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -68.23 -46.04 71.63 Favored 'General case' 0 CA--C 1.538 0.504 0 CA-C-N 115.799 -0.637 . . . . 0.0 109.477 174.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 23.5 tpp180 -64.95 -33.88 77.09 Favored 'General case' 0 C--N 1.326 -0.436 0 CA-C-N 115.399 -0.818 . . . . 0.0 109.903 179.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.7 tp -70.88 -29.24 65.28 Favored 'General case' 0 C--N 1.311 -1.079 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.203 178.038 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 6.0 tpm_? -72.7 -57.2 4.29 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 179.392 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 65.2 m-20 . . . . . 0 C--N 1.299 -1.628 0 CA-C-N 116.029 -0.532 . . . . 0.0 110.567 -179.435 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.513 -0.476 0 CA-C-O 121.085 0.469 . . . . 0.0 111.63 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 55.7 mttp -67.63 -34.66 77.41 Favored 'General case' 0 C--N 1.312 -1.062 0 CA-C-N 115.516 -0.766 . . . . 0.0 110.164 -178.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -70.13 -26.91 64.17 Favored 'General case' 0 C--N 1.318 -0.802 0 CA-C-O 121.433 0.635 . . . . 0.0 111.036 178.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 16.7 m -74.97 -30.67 61.26 Favored 'General case' 0 C--N 1.303 -1.448 0 CA-C-N 115.157 -0.929 . . . . 0.0 108.907 178.142 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 mm-40 -65.98 -42.44 89.84 Favored 'General case' 0 N--CA 1.449 -0.486 0 CA-C-N 115.441 -0.8 . . . . 0.0 109.547 176.06 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 47.8 mt -62.42 -46.35 96.62 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.851 0 N-CA-C 108.527 -0.916 . . . . 0.0 108.527 176.685 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -54.52 -44.37 72.7 Favored 'General case' 0 CA--C 1.549 0.924 0 CA-C-N 114.454 -1.248 . . . . 0.0 110.695 178.282 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -68.91 -41.57 78.04 Favored 'General case' 0 C--O 1.216 -0.7 0 O-C-N 122.175 -0.328 . . . . 0.0 110.412 175.732 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.459 ' O ' ' HB3' ' A' ' 12' ' ' GLN . 35.3 tt0 -57.11 -40.64 77.43 Favored 'General case' 0 C--N 1.325 -0.479 0 C-N-CA 123.556 0.742 . . . . 0.0 111.807 -179.734 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 74.8 t90 -60.44 -50.43 73.63 Favored 'General case' 0 C--N 1.314 -0.936 0 O-C-N 123.473 0.483 . . . . 0.0 110.195 178.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 93.9 m -69.75 -30.34 67.91 Favored 'General case' 0 C--N 1.309 -1.177 0 CA-C-N 116.19 -0.459 . . . . 0.0 112.2 178.413 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.459 ' HB3' ' O ' ' A' ' 9' ' ' GLN . 8.3 tt0 -55.74 -46.59 77.76 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.002 0.921 . . . . 0.0 110.146 177.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 37.0 t -83.29 -29.66 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.814 0 CA-C-N 115.317 -0.856 . . . . 0.0 110.189 -178.373 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 28.0 ttt -61.72 -53.06 61.2 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.632 -0.258 . . . . 0.0 111.053 179.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.483 ' HG3' ' HA3' ' A' ' 18' ' ' GLY . 17.4 tppt? -148.3 94.28 4.25 Favored Pre-proline 0 N--CA 1.436 -1.169 0 C-N-CA 120.394 -0.522 . . . . 0.0 111.664 -177.526 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 13.1 Cg_exo -72.86 122.05 7.84 Favored 'Trans proline' 0 N--CA 1.454 -0.794 0 C-N-CA 122.61 2.206 . . . . 0.0 110.805 176.681 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 29.6 mm-40 65.1 19.18 11.74 Favored 'General case' 0 N--CA 1.473 0.692 0 N-CA-C 113.864 1.061 . . . . 0.0 113.864 176.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.483 ' HA3' ' HG3' ' A' ' 15' ' ' LYS . . . -92.62 95.86 2.06 Favored Glycine 0 CA--C 1.491 -1.457 0 N-CA-C 110.159 -1.177 . . . . 0.0 110.159 178.128 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -43.49 -51.59 6.53 Favored Glycine 0 C--O 1.22 -0.758 0 O-C-N 124.856 0.974 . . . . 0.0 115.394 -172.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.412 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 0.1 OUTLIER -69.07 -45.62 69.87 Favored 'General case' 0 C--N 1.311 -1.096 0 CA-C-N 117.218 0.509 . . . . 0.0 112.073 -175.414 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 -69.29 -42.14 75.86 Favored 'General case' 0 C--N 1.317 -0.819 0 CA-C-O 121.753 0.787 . . . . 0.0 109.558 -175.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 49.2 tt0 -69.76 -35.57 75.04 Favored 'General case' 0 C--N 1.306 -1.288 0 CA-C-N 114.383 -1.281 . . . . 0.0 109.643 -176.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 43.4 ttt180 -68.23 -39.82 82.21 Favored 'General case' 0 N--CA 1.446 -0.669 0 N-CA-C 109.889 -0.412 . . . . 0.0 109.889 177.227 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 27.6 mmm180 -62.57 -42.72 99.72 Favored 'General case' 0 CA--C 1.507 -0.707 0 CA-C-N 116.127 -0.488 . . . . 0.0 109.779 176.552 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 35.9 m -58.22 -45.26 88.01 Favored 'General case' 0 C--O 1.215 -0.724 0 CA-C-N 115.813 -0.631 . . . . 0.0 111.463 174.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 20.4 tt0 -53.98 -53.77 48.21 Favored 'General case' 0 C--N 1.331 -0.203 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 178.198 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 53.8 mt-30 -62.13 -51.08 69.34 Favored 'General case' 0 C--N 1.323 -0.56 0 CA-C-N 115.242 -0.89 . . . . 0.0 112.112 -178.471 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -69.78 -42.71 73.43 Favored 'General case' 0 C--N 1.319 -0.718 0 N-CA-C 112.747 0.647 . . . . 0.0 112.747 -176.025 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 47.8 t -63.77 -38.68 92.01 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-O 120.687 0.279 . . . . 0.0 110.491 -177.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -76.08 -33.87 59.53 Favored 'General case' 0 N--CA 1.447 -0.589 0 CA-C-N 116.52 -0.309 . . . . 0.0 111.526 178.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -68.14 -38.51 82.26 Favored 'General case' 0 C--N 1.325 -0.486 0 CA-C-O 121.646 0.736 . . . . 0.0 109.459 178.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.437 ' HA ' ' NE ' ' A' ' 32' ' ' ARG . 4.6 tpm_? -67.32 -36.21 81.01 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.313 -0.858 . . . . 0.0 109.743 177.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 66.7 tp -75.37 -48.63 22.07 Favored 'General case' 0 C--N 1.307 -1.265 0 CA-C-N 115.301 -0.863 . . . . 0.0 112.129 -177.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -101.17 114.75 29.0 Favored 'General case' 0 C--N 1.299 -1.62 0 CA-C-O 120.997 0.427 . . . . 0.0 111.813 -173.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 31.2 t70 . . . . . 0 C--N 1.303 -1.449 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 175.59 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PCA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.308 0 CA-C-O 121.483 0.659 . . . . 0.0 110.467 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . . 93.5 mttt -68.55 -49.57 58.5 Favored 'General case' 0 C--N 1.317 -0.84 0 CA-C-N 115.016 -0.993 . . . . 0.0 109.698 -177.8 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -63.63 -37.74 88.46 Favored 'General case' 0 CA--C 1.507 -0.682 0 CA-C-N 115.174 -0.921 . . . . 0.0 110.646 -179.222 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -64.84 -46.46 81.81 Favored 'General case' 0 C--N 1.282 -2.334 0 CA-C-N 113.847 -1.524 . . . . 0.0 109.135 -179.785 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 -64.03 -51.89 62.02 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.073 -0.967 . . . . 0.0 111.56 179.952 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 22.6 pt -62.91 -39.15 83.97 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.547 0 N-CA-C 112.128 0.418 . . . . 0.0 112.128 -179.03 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 37.6 t -61.69 -32.98 73.21 Favored 'General case' 0 C--O 1.247 0.923 0 CA-C-O 120.943 0.402 . . . . 0.0 109.923 176.747 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.412 HH11 ' HD3' ' A' ' 8' ' ' ARG . 8.8 tpt180 -71.56 -48.5 48.13 Favored 'General case' 0 N--CA 1.439 -0.984 0 N-CA-C 109.813 -0.44 . . . . 0.0 109.813 174.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -54.25 -43.84 71.28 Favored 'General case' 0 N--CA 1.479 0.979 0 O-C-N 123.639 0.587 . . . . 0.0 111.145 -179.41 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' TRP . . . . . . . . . . . . . 59.1 m95 -52.08 -49.02 64.36 Favored 'General case' 0 C--N 1.327 -0.391 0 O-C-N 123.838 0.711 . . . . 0.0 111.727 177.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 61.2 m -80.29 -23.83 40.43 Favored 'General case' 0 C--N 1.309 -1.192 0 N-CA-C 112.611 0.597 . . . . 0.0 112.611 178.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.2 tp60 -71.26 -32.72 69.06 Favored 'General case' 0 C--N 1.319 -0.737 0 N-CA-C 109.415 -0.587 . . . . 0.0 109.415 -179.219 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.6 t -82.0 -34.17 12.32 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.756 0 N-CA-C 109.036 -0.727 . . . . 0.0 109.036 176.098 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' MET . . . . . . . . . . . . . 25.3 ttt -61.31 -55.14 35.09 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.828 -179.823 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 48.4 mmtm -146.45 87.46 6.48 Favored Pre-proline 0 C--N 1.312 -1.063 0 N-CA-C 109.438 -0.578 . . . . 0.0 109.438 179.439 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -67.8 120.28 7.29 Favored 'Trans proline' 0 N--CA 1.452 -0.96 0 C-N-CA 121.827 1.685 . . . . 0.0 110.822 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 63.97 32.54 13.0 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.336 0.654 . . . . 0.0 110.381 -179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -74.44 168.29 54.51 Favored Glycine 0 N--CA 1.437 -1.28 0 CA-C-N 115.458 -0.792 . . . . 0.0 113.042 -178.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -100.58 -92.32 2.11 Favored Glycine 0 N--CA 1.421 -2.311 0 N-CA-C 111.355 -0.698 . . . . 0.0 111.355 -179.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.487 ' H ' ' CD ' ' A' ' 20' ' ' GLU . 3.5 mp0 -51.28 -51.7 51.79 Favored 'General case' 0 C--N 1.323 -0.562 0 C-N-CA 124.367 1.067 . . . . 0.0 110.846 -177.501 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -68.17 -35.27 77.78 Favored 'General case' 0 C--N 1.315 -0.908 0 CA-C-N 115.146 -0.933 . . . . 0.0 111.803 -174.339 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 53.5 tt0 -76.2 -36.0 58.82 Favored 'General case' 0 C--N 1.32 -0.708 0 C-N-CA 119.997 -0.681 . . . . 0.0 110.391 -179.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 2.9 tmt_? -61.76 -43.92 97.9 Favored 'General case' 0 C--O 1.241 0.658 0 N-CA-C 107.474 -1.306 . . . . 0.0 107.474 175.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ARG . . . . . . . . . . . . . 16.3 tpp180 -56.94 -51.2 70.09 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-N 114.806 -1.088 . . . . 0.0 109.767 175.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 m -55.49 -39.58 70.61 Favored 'General case' 0 CA--C 1.511 -0.556 0 N-CA-C 113.56 0.948 . . . . 0.0 113.56 178.232 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 34.8 tt0 -60.54 -54.01 50.57 Favored 'General case' 0 C--N 1.33 -0.24 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 177.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 mm-40 -61.17 -42.8 99.22 Favored 'General case' 0 C--N 1.326 -0.442 0 CA-C-N 115.359 -0.837 . . . . 0.0 111.769 -177.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -67.2 -43.81 81.2 Favored 'General case' 0 C--N 1.318 -0.77 0 N-CA-C 111.809 0.3 . . . . 0.0 111.809 177.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 13.1 t -67.38 -45.89 74.92 Favored 'General case' 0 C--N 1.316 -0.882 0 CA-C-N 116.592 -0.276 . . . . 0.0 110.432 -175.411 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -68.09 -27.89 66.87 Favored 'General case' 0 C--O 1.218 -0.563 0 C-N-CA 120.41 -0.516 . . . . 0.0 112.097 -179.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -75.73 -34.05 60.31 Favored 'General case' 0 C--N 1.316 -0.862 0 CA-C-O 121.136 0.494 . . . . 0.0 110.09 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 32.8 tpt180 -76.28 -53.35 8.34 Favored 'General case' 0 C--N 1.322 -0.609 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.242 -177.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -78.41 -48.26 15.83 Favored 'General case' 0 C--N 1.322 -0.614 0 C-N-CA 120.535 -0.466 . . . . 0.0 110.748 -178.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 41.7 ttm180 56.54 82.25 0.12 Allowed 'General case' 0 C--O 1.238 0.484 0 CA-C-O 122.231 1.015 . . . . 0.0 112.316 178.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 22.8 t70 . . . . . 0 C--N 1.298 -1.664 0 CA-C-N 114.167 -1.379 . . . . 0.0 108.991 -179.122 . . . . . . . . 0 0 . 1 stop_ save_